N-[2-[4-(Aminosulfonyl)phenyl]ethyl]-5-chloro-2-methoxybenzamide

C16H17ClN2O4SCAS 16673-34-0368.83 g/mol

Open in Covalent MOL file
OClOHNSH2NOO
Aryl halideEtherSulfonamide

Properties

Molecular formula
C16H17ClN2O4S
Molar mass
368.83 g/mol
Exact mass
368.0598 Da
Melting point
213–215 °C
logP
2.54Crippen estimate
Polar surface area
102.0 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
16673-34-0
SMILES
COc1ccc(Cl)cc1C(O)=NCCc1ccc(S(N)(=O)=O)cc1
InChIKey
KVWWTCSJLGHLRM-UHFFFAOYSA-N
InChI
InChI=1S/C16H17ClN2O4S/c1-23-15-7-4-12(17)10-14(15)16(20)19-9-8-11-2-5-13(6-3-11)24(18,21)22/h2-7,10H,8-9H2,1H3,(H,19,20)(H2,18,21,22)

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Names and synonyms

6 names
  • Benzamide, N-[2-[4-(aminosulfonyl)phenyl]ethyl]-5-chloro-2-methoxy-
  • o-Anisamide, 5-chloro-N-(p-sulfamoylphenethyl)-
  • 4-[2-(5-Chloro-2-methoxybenzamido)ethyl]phenylsulfonamide
  • 4-[2-(2-Methoxy-5-chlorobenzene-1-carboxamido)ethyl]benzenesulfonamide
  • 5-Chloro-2-methoxy-N-(4-sulfamoylphenethyl)benzamide
  • 5-Chloro-2-methoxy-N-(2-(4-sulfamoylphenyl)ethyl)benzamide

Work with N-[2-[4-(Aminosulfonyl)phenyl]ethyl]-5-chloro-2-methoxybenzamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Glibenclamide10238-21-861 % similar N-[2-[4-(Aminosulfonyl)phenyl]ethyl]acetamide41472-49-550 % similar (±)-Sulpiride15676-16-149 % similar Levosulpiride23672-07-349 % similar 4-[2-(5-Methylpyrazine-2-carboxamido)ethyl]benzenesulfonamide33288-71-049 % similar 5-(Aminosulfonyl)-2-methoxybenzoic acid22117-85-748 % similar Tiapride51012-32-946 % similar Methyl 2-methoxy-5-sulfamoylbenzoate33045-52-246 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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