4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide

C22H22N2O4S — CID 2687763

IUPAC4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1
InChIInChI=1S/C22H22N2O4S/c1-16(17-8-4-3-5-9-17)23-22(25)18-12-14-19(15-13-18)29(26,27)24-20-10-6-7-11-21(20)28-2/h3-16,24H,1-2H3,(H,23,25)/t16-/m0/s1
InChIKeyOBPZVOHZKSRUDX-INIZCTEOSA-N
MW410.50 g/mol
LogP3.99
Rot. Bonds7

About 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide

4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide (PubChem CID 2687763) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide
PubChem CID2687763
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC Name4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide
SMILESCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1
InChIInChI=1S/C22H22N2O4S/c1-16(17-8-4-3-5-9-17)23-22(25)18-12-14-19(15-13-18)29(26,27)24-20-10-6-7-11-21(20)28-2/h3-16,24H,1-2H3,(H,23,25)/t16-/m0/s1
InChIKeyOBPZVOHZKSRUDX-INIZCTEOSA-N
XLogP3.99
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(2-methoxyphenyl)sulfamoyl]-N-(1-thiophen-2-ylethyl)benzamide
CID 43003138
4-[(2-chlorophenyl)sulfamoyl]-N-(1-phenylethyl)benzamide
CID 55346393
4-[(4-fluorophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 9315283
4-[(4-fluorophenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]benzamide
CID 9315282
4-[(2-methoxyphenyl)sulfamoyl]-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 43062290
4-(benzenesulfonamido)-N-[1-(3,4-dimethoxyphenyl)ethyl]-3-methylbenzamide
CID 46764267
4-[(2-methoxyphenyl)sulfamoyl]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120832379
4-(benzenesulfonamido)-3-chloro-N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]benzamide
CID 94020081
propan-2-yl 2-[[4-[(2-methoxyphenyl)sulfamoyl]benzoyl]amino]acetate
CID 56546673
4-[(4-bromophenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 2090399
4-[(2-methoxyphenyl)sulfamoyl]-N-(1-pyrazol-1-ylpropan-2-yl)benzamide
CID 43064966
4-[(2-methoxyphenyl)sulfamoyl]-N-(3-propan-2-yloxypropyl)benzamide
CID 26861429

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide?
The IUPAC name of 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide (CID 2687763) is 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide.
What is the SMILES notation for 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide?
The canonical SMILES for 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide is COc1ccccc1NS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1.
What is the InChIKey of 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide?
The InChIKey is OBPZVOHZKSRUDX-INIZCTEOSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-16(17-8-4-3-5-9-17)23-22(25)18-12-14-19(15-13-18)29(26,27)24-20-10-6-7-11-21(20)28-2/h3-16,24H,1-2H3,(H,23,25)/t16-/m0/s1.
What are the key properties of 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide?
4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide has a molecular weight of 410.50 g/mol, XLogP of 3.99, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)sulfamoyl]-N-[(1S)-1-phenylethyl]benzamide is sourced from PubChem (CID 2687763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).