N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide

C20H17N3O2S — CID 2474403

IUPACN-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide
SMILESCc1nc2cc(NS(=O)(=O)c3ccccc3)ccc2n1-c1ccccc1
InChIInChI=1S/C20H17N3O2S/c1-15-21-19-14-16(22-26(24,25)18-10-6-3-7-11-18)12-13-20(19)23(15)17-8-4-2-5-9-17/h2-14,22H,1H3
InChIKeyFHUNRZOIQPVKQN-UHFFFAOYSA-N
MW363.44 g/mol
LogP4.13
Rot. Bonds4

About N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide

N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide (PubChem CID 2474403) has the molecular formula C20H17N3O2S and a molecular weight of 363.44 g/mol. Its IUPAC name is N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound NameN-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide
PubChem CID2474403
Molecular FormulaC20H17N3O2S
Molecular Weight363.44 g/mol
Exact Mass363.10
IUPAC NameN-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide
SMILESCc1nc2cc(NS(=O)(=O)c3ccccc3)ccc2n1-c1ccccc1
InChIInChI=1S/C20H17N3O2S/c1-15-21-19-14-16(22-26(24,25)18-10-6-3-7-11-18)12-13-20(19)23(15)17-8-4-2-5-9-17/h2-14,22H,1H3
InChIKeyFHUNRZOIQPVKQN-UHFFFAOYSA-N
XLogP4.13
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.44
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-2-methyl-N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide
CID 59018209
N-(2-methyl-1-phenylbenzimidazol-5-yl)formamide
CID 56696508
4-methyl-N-[3-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzenesulfonamide
CID 7553748
3-methyl-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzenesulfonamide
CID 7161308
3-chloro-N-[4-(2-methyl-4-oxoquinazolin-3-yl)phenyl]benzenesulfonamide
CID 16803205
1-(2-methyl-1-phenylbenzimidazol-5-yl)ethanone
CID 3494565
N-(2-methyl-1-phenylbenzimidazol-5-yl)-3-[(R)-methylsulfinyl]propanamide
CID 97329327
N-(2-methyl-1-phenylbenzimidazol-5-yl)-4-[(R)-methylsulfinyl]benzamide
CID 94186960
4-[bis(2-methylpropyl)sulfamoyl]-N-(2-methyl-1-phenylbenzimidazol-5-yl)benzamide
CID 3567557
1-(2-methyl-1-phenylbenzimidazol-5-yl)pyridin-4-one
CID 2999009
N-quinoxalin-6-ylbenzenesulfonamide
CID 3860445
N-[2-(4-methoxyphenyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-8-yl]benzenesulfonamide
CID 2038541

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide?
The IUPAC name of N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide (CID 2474403) is N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide.
What is the SMILES notation for N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide?
The canonical SMILES for N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide is Cc1nc2cc(NS(=O)(=O)c3ccccc3)ccc2n1-c1ccccc1.
What is the InChIKey of N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide?
The InChIKey is FHUNRZOIQPVKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2S/c1-15-21-19-14-16(22-26(24,25)18-10-6-3-7-11-18)12-13-20(19)23(15)17-8-4-2-5-9-17/h2-14,22H,1H3.
What are the key properties of N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide?
N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide has a molecular weight of 363.44 g/mol, XLogP of 4.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylbenzimidazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 2474403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).