4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide

C17H20N2O5S — CID 1262329

IUPAC4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(S(=O)(=O)N(CCO)CCO)cc1
InChIInChI=1S/C17H20N2O5S/c20-12-10-19(11-13-21)25(23,24)16-8-6-14(7-9-16)17(22)18-15-4-2-1-3-5-15/h1-9,20-21H,10-13H2,(H,18,22)
InChIKeyVNKKYUCREAUXBV-UHFFFAOYSA-N
MW364.42 g/mol
LogP0.91
Rot. Bonds8

About 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide

4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide (PubChem CID 1262329) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide
PubChem CID1262329
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC Name4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(S(=O)(=O)N(CCO)CCO)cc1
InChIInChI=1S/C17H20N2O5S/c20-12-10-19(11-13-21)25(23,24)16-8-6-14(7-9-16)17(22)18-15-4-2-1-3-5-15/h1-9,20-21H,10-13H2,(H,18,22)
InChIKeyVNKKYUCREAUXBV-UHFFFAOYSA-N
XLogP0.91
TPSA106.94 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 50.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-fluoro-3-(4-hydroxypiperidin-1-yl)sulfonyl-N-(3,4,5-trifluorophenyl)benzamide
CID 89663273
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CID 721954
N-[4-(Aminosulfonyl)phenyl]-2-mercaptobenzamide
CID 462919
N-Benzyl-N-butyl-4-(N-phenylsulfamoyl)benzamide
CID 137796294
N-[4-(4-morpholinylsulfonyl)phenyl]benzamide
CID 2811587
N-Phenyl-3-(1-piperidinylsulfonyl)benzamide
CID 558837
N-(4-cyanophenyl)-3-(diethylsulfamoyl)benzamide
CID 3241048
N-butyl-4-[(phenylsulfonyl)amino]benzamide
CID 2224401
Copper(2+) ion 2-[(carboxylatomethyl)({[(3-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)carbamoyl]methyl})amino]acetate
CID 91895867
4-fluoro-N-[(2S)-1-[4-[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl]anilino]-1-oxo-3-phenylpropan-2-yl]benzamide
CID 156160306
N-(2-hydroxyethyl)-4-(4-sulfamoylphenyl)benzamide
CID 122194774
4-methyl-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]benzamide
CID 738960

Frequently Asked Questions

What is the IUPAC name of 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide?
The IUPAC name of 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide (CID 1262329) is 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide?
The canonical SMILES for 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccc(S(=O)(=O)N(CCO)CCO)cc1.
What is the InChIKey of 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide?
The InChIKey is VNKKYUCREAUXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c20-12-10-19(11-13-21)25(23,24)16-8-6-14(7-9-16)17(22)18-15-4-2-1-3-5-15/h1-9,20-21H,10-13H2,(H,18,22).
What are the key properties of 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide?
4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide has a molecular weight of 364.42 g/mol, XLogP of 0.91, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[bis(2-hydroxyethyl)sulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 1262329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).