1-[2-(benzenesulfonamido)phenyl]-3-phenylurea

C19H17N3O3S — CID 10044483

IUPAC1-[2-(benzenesulfonamido)phenyl]-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C19H17N3O3S/c23-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)22-26(24,25)16-11-5-2-6-12-16/h1-14,22H,(H2,20,21,23)
InChIKeyBGLZECVIKIGPIF-UHFFFAOYSA-N
MW367.43 g/mol
LogP4.13
Rot. Bonds5

About 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea

1-[2-(benzenesulfonamido)phenyl]-3-phenylurea (PubChem CID 10044483) has the molecular formula C19H17N3O3S and a molecular weight of 367.43 g/mol. Its IUPAC name is 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea.

Molecular Properties

Compound Name1-[2-(benzenesulfonamido)phenyl]-3-phenylurea
PubChem CID10044483
Molecular FormulaC19H17N3O3S
Molecular Weight367.43 g/mol
Exact Mass367.10
IUPAC Name1-[2-(benzenesulfonamido)phenyl]-3-phenylurea
SMILESO=C(Nc1ccccc1)Nc1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C19H17N3O3S/c23-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)22-26(24,25)16-11-5-2-6-12-16/h1-14,22H,(H2,20,21,23)
InChIKeyBGLZECVIKIGPIF-UHFFFAOYSA-N
XLogP4.13
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.43
LogP ≤ 54.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

Slc-0111
CID 310360
3-(3-Phenyl-ureido)-benzenesulfonamide
CID 2812287
4-[(Anilinocarbonyl)amino]benzenesulfonamide
CID 306924
1-Phenyl-3-[4-(phenylsulfamoyl)phenyl]thiourea
CID 3421033
4-{[(Pentafluorophenyl)carbamoyl]amino}benzenesulfonamide
CID 11245996
1-(4-Aminophenyl)-3-(4-sulfamoylphenyl)urea
CID 43468983
1-(2,6-Difluorophenyl)-3-(4-sulfamoylphenyl)urea
CID 56836511
4-{[(Cyclohexylamino)carbonyl]amino}benzenesulfonamide
CID 1226644
N-[4-(aminosulfonyl)phenyl]-4-[(anilinocarbonothioyl)amino]benzenesulfonamide
CID 2292578
N-phenyl-N'-[4-(1-piperidinylsulfonyl)phenyl]urea
CID 1011581
1-(2-Fluorophenyl)-3-(4-sulfamoylphenyl)urea
CID 306968
4-[(aminocarbonyl)amino]-N-[4-(aminosulfonyl)phenyl]benzenesulfonamide
CID 397555

Frequently Asked Questions

What is the IUPAC name of 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea?
The IUPAC name of 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea (CID 10044483) is 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea.
What is the SMILES notation for 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea?
The canonical SMILES for 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea is O=C(Nc1ccccc1)Nc1ccccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea?
The InChIKey is BGLZECVIKIGPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3S/c23-19(20-15-9-3-1-4-10-15)21-17-13-7-8-14-18(17)22-26(24,25)16-11-5-2-6-12-16/h1-14,22H,(H2,20,21,23).
What are the key properties of 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea?
1-[2-(benzenesulfonamido)phenyl]-3-phenylurea has a molecular weight of 367.43 g/mol, XLogP of 4.13, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(benzenesulfonamido)phenyl]-3-phenylurea is sourced from PubChem (CID 10044483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).