3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide

C23H17N3O2S — CID 17361308

IUPAC3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1cccc(C(=O)Nc2nccs2)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H17N3O2S/c27-21(18-11-9-17(10-12-18)16-5-2-1-3-6-16)25-20-8-4-7-19(15-20)22(28)26-23-24-13-14-29-23/h1-15H,(H,25,27)(H,24,26,28)
InChIKeyTWTYKPSZROWOQK-UHFFFAOYSA-N
MW399.48 g/mol
LogP5.31
Rot. Bonds5

About 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide

3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 17361308) has the molecular formula C23H17N3O2S and a molecular weight of 399.48 g/mol. Its IUPAC name is 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
PubChem CID17361308
Molecular FormulaC23H17N3O2S
Molecular Weight399.48 g/mol
Exact Mass399.10
IUPAC Name3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1cccc(C(=O)Nc2nccs2)c1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C23H17N3O2S/c27-21(18-11-9-17(10-12-18)16-5-2-1-3-6-16)25-20-8-4-7-19(15-20)22(28)26-23-24-13-14-29-23/h1-15H,(H,25,27)(H,24,26,28)
InChIKeyTWTYKPSZROWOQK-UHFFFAOYSA-N
XLogP5.31
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500399.48
LogP ≤ 55.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4-dimethyl-N-[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 9321514
N-(1,3-thiazol-2-yl)benzamide;hydrochloride
CID 141066064
N-[4-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]phenyl]furan-2-carboxamide
CID 17361346
3-[[(2R)-2-methylbutanoyl]amino]-N-(1,3-thiazol-2-yl)benzamide
CID 27262078
N-hydroxy-3-[(4-phenylbenzoyl)amino]benzamide
CID 142750431
2-ethoxy-N-[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 9321520
4-amino-3-phenyl-N-(1,3-thiazol-2-yl)benzamide
CID 86046995
3-(2-ethylbutanoylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 977043
3-hydroxy-N-(1,3-thiazol-2-yl)benzamide
CID 17362164
(1R,6R)-6-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 1312895
trans-(1S,2S)-2-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1314181
trans-(1R,2R)-2-[[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1314180

Frequently Asked Questions

What is the IUPAC name of 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide (CID 17361308) is 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide is O=C(Nc1cccc(C(=O)Nc2nccs2)c1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is TWTYKPSZROWOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O2S/c27-21(18-11-9-17(10-12-18)16-5-2-1-3-6-16)25-20-8-4-7-19(15-20)22(28)26-23-24-13-14-29-23/h1-15H,(H,25,27)(H,24,26,28).
What are the key properties of 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide?
3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 399.48 g/mol, XLogP of 5.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-phenylbenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 17361308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).