N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide

C21H14N2O3S — CID 5033052

IUPACN-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide
SMILESO=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccco1
InChIInChI=1S/C21H14N2O3S/c24-18(15-10-5-2-6-11-15)19-17(14-8-3-1-4-9-14)22-21(27-19)23-20(25)16-12-7-13-26-16/h1-13H,(H,22,23,25)
InChIKeyIKMNLKQUUGRBCM-UHFFFAOYSA-N
MW374.42 g/mol
LogP4.89
Rot. Bonds5

About N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide

N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide (PubChem CID 5033052) has the molecular formula C21H14N2O3S and a molecular weight of 374.42 g/mol. Its IUPAC name is N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide
PubChem CID5033052
Molecular FormulaC21H14N2O3S
Molecular Weight374.42 g/mol
Exact Mass374.07
IUPAC NameN-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide
SMILESO=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccco1
InChIInChI=1S/C21H14N2O3S/c24-18(15-10-5-2-6-11-15)19-17(14-8-3-1-4-9-14)22-21(27-19)23-20(25)16-12-7-13-26-16/h1-13H,(H,22,23,25)
InChIKeyIKMNLKQUUGRBCM-UHFFFAOYSA-N
XLogP4.89
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.42
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide 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

2-(2-furoylamino)-N-mesityl-4-methyl-1,3-thiazole-5-carboxamide
CID 21911271
N-(2-chloro-6-methylphenyl)-2-(2-furoylamino)-4-methyl-1,3-thiazole-5-carboxamide
CID 21911611
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide
CID 694812
N-(4,5-dimethyl-1,3-thiazol-2-yl)-1-benzofuran-2-carboxamide
CID 734562
N-benzo[e][1,3]benzothiazol-2-ylfuran-2-carboxamide
CID 565816
N-(4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 674790
N-(1,3-benzothiazol-2-yl)furan-2-carboxamide
CID 715680
Furan-2-carboxylic acid (4-phenyl-5-pyridin-4-yl-thiazol-2-yl)-amide
CID 72197880
A1AR antagonist 3
CID 129834603
A1/A3 AR antagonist 2
CID 162673862
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)furan-2-carboxamide
CID 702340
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
CID 733820

Frequently Asked Questions

What is the IUPAC name of N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide?
The IUPAC name of N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide (CID 5033052) is N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide.
What is the SMILES notation for N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide?
The canonical SMILES for N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide is O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1ccco1.
What is the InChIKey of N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide?
The InChIKey is IKMNLKQUUGRBCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N2O3S/c24-18(15-10-5-2-6-11-15)19-17(14-8-3-1-4-9-14)22-21(27-19)23-20(25)16-12-7-13-26-16/h1-13H,(H,22,23,25).
What are the key properties of N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide?
N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide has a molecular weight of 374.42 g/mol, XLogP of 4.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-benzoyl-4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide is sourced from PubChem (CID 5033052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).