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Molecule
Indapamide
CAS: 26807-65-8 · C16H16ClN3O3S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 26807-65-8
- Molecular Formula
- C16H16ClN3O3S
- Molecular Mass
- 365.84 g/mol
Identifiers
CAS Registry Number
26807-65-8
SMILES
CC1Cc2ccccc2N1N=C(O)c1ccc(Cl)c(S(N)(=O)=O)c1
InChI Key
NDDAHWYSQHTHNT-UHFFFAOYSA-N
InChI
InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)
Names and Synonyms
- Indapamide Synonym
- Benzamide, 3-(aminosulfonyl)-4-chloro-N-(2,3-dihydro-2-methyl-1H-indol-1-yl)- Synonym
- Benzamide, 4-chloro-N-(2-methyl-1-indolinyl)-3-sulfamoyl- Synonym
- 3-(Aminosulfonyl)-4-chloro-N-(2,3-dihydro-2-methyl-1H-indol-1-yl)benzamide Synonym
- Indapamide Synonym
- SE 1520 Synonym
- S 1520 Synonym
- Lozol Synonym
- Tertensif Synonym
- (±)-Indapamide Synonym
- Racemic indapamide Synonym
- Fludin Synonym
- Fludex Synonym
- Flupamid Synonym
- Flubest Synonym
- Indamide Synonym
- Natrilix Synonym
- Veroxil Synonym
- Damide Synonym
- Ipamix Synonym
- Tandix Synonym
- Indaflex Synonym
- Bajaten Synonym
- Indamol Synonym
- Noranat Synonym
- Arifon Synonym
- Lorvas Synonym
- KYD 041 Synonym
- Natrix Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 365.84 g/mol | CAS Common Chemistry |
| 365.84200000000004 g/mol | RDKit | |
| 365.842 g/mol | RDKit | |
| 365.832 g/mol | chempirical lib | |
| Canonical SMILES | O=C(NN1C=2C=CC=CC2CC1C)C3=CC=C(Cl)C(=C3)S(=O)(=O)N | CAS Common Chemistry |
| InChI | InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23) | CAS Common Chemistry |
| InChI Key | InChIKey=NDDAHWYSQHTHNT-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 161 °C | CAS Common Chemistry |
| Name | Indapamide | CAS Common Chemistry |
| Heavy Atom Count | 24 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 95.98999999999998 Ų | RDKit |
| 95.99 Ų | RDKit | |
| LogP | 2.658200000000001 | RDKit |
| 2.6582 | RDKit | |
| 2.53 | chempirical lib | |
| Molar Refractivity | 94.07800000000003 cm³/mol | RDKit |
| Ring Count | 3 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.1875 | RDKit |
| 0.19 | chempirical lib | |
| Exact Mass | 365.060090052 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 365.84 g/mol. Edit any field — others recompute live.
