Back to Search
Fuluobi
CAS: 54-31-9 | C12H11ClN2O5S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
54-31-9
Molecular Formula:
C12H11ClN2O5S
Molecular Weight:
330.749 g/mol
Names and Synonyms:
Fuluobi
Pharlab
Neosemid
Furosemide-Darnitsa
Teuto
Furosem
Frusenex
Desal
NSC 269420
Furosedon
Rusyde
Lowpston
Profemin
Discoid
Mirfat
Diuretic salt
Disal
Hydro-rapid
Zafurida
Yidoli
Uridon
Urian
Urex M
Uresix
Durafurid
Uremide
Selectofur
Salurid
Salinex
Retep
Radisemide
Promide
Promedes
Oedemex
Odemex
Odemase
Nephron
Nelsix
Nadis
Urenil
Marsemide
Liside
Laxur
Lasix Retard
Lasiletten
Lasemid
Kutrix
Kofuzon
Impugan
Hydro
Hydrex
Hissuflux
Golan
Furovite
Furoter
Furosix
Furosan
Furorese
Furo-Puren
Furomide M.D.
Furomex
Furomen
Furodiurol
Furocot
Furo-Basan
Frumide
Furix
Furex
Furetic
Furanturil
Frusid
Frusetic
Frusema
Frusedan
Furmid
Frumex
Franyl
Fluidrol
Eutensin
Aquasin
Aquamide
Dryptal
Dranex
Diusil
Diusemide
Diurolasa
Diurin
Diuresal
Diural
Disemide
Dirine
Bioretic
Arasemide
Aldic
Naclex
Aquarid
Apo-Furosemide
Apo-Frusemide
Anfuramaide
Aluzine
2-Furfurylamino-4-chloro-5-sulfamoylbenzoic acid
Radonna
Furesis
Furanthril
Lasex
Fusid
Urex
Furosemide
Cetasix
Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]-
Anthranilic acid, 4-chloro-N-furfuryl-5-sulfamoyl-
5-(Aminosulfonyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoic acid
LB 502
4-Chloro-N-furfuryl-5-sulfamoylanthranilic acid
4-Chloro-N-(2-furylmethyl)-5-sulfamoylanthranilic acid
Furosemid
Furosemide
Lasix
Frusemide
Furanthryl
Trofurit
5-(Aminosulfamyl)-4-chloro-2-[(2-furanylmethyl)amino]benzoic acid
Aisemide
Beronald
Desdemin
Errolon
Frusemin
Fulsix
Fuluvamide
Katlex
Lasilix
Lowpstron
Macasirool
Prefemin
Nicorol
Rosemide
Transit
Furantril
Seguril
Salix
Identifiers:
SMILES:
NS(=O)(=O)c1cc(C(=O)O)c(NCc2ccco2)cc1Cl
InChI:
InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 330.75 g/mol | Legacy Database |
| cas-canonical-smile | O=C(O)C1=CC(=C(Cl)C=C1NCC=2OC=CC2)S(=O)(=O)N None | Legacy Database |
| cas-inchi | InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19) None | Legacy Database |
| cas-inchi-key | InChIKey=ZZUFCTLCJUWOSV-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 206 °C None | Legacy Database |
| cas-name | Furosemide None | Legacy Database |
| LogP | 1.8907 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 330.749 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 330.00772013200003 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 21 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 5 count | RDKit |
| Hydrogen Bond Donors | 3 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 5 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 2 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 122.63000000000001 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 75.81920000000002 | RDKit |
