4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C14H14ClN3O3S — CID 3350292

IUPAC4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1nc(C)cs1
InChIInChI=1S/C14H14ClN3O3S/c1-7-6-22-14(16-7)18-13(20)9-4-10(15)11(17-8(2)19)5-12(9)21-3/h4-6H,1-3H3,(H,17,19)(H,16,18,20)
InChIKeyJNNDYGMHTXLHQK-UHFFFAOYSA-N
MW339.80 g/mol
LogP3.32
Rot. Bonds4

About 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide

4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 3350292) has the molecular formula C14H14ClN3O3S and a molecular weight of 339.80 g/mol. Its IUPAC name is 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID3350292
Molecular FormulaC14H14ClN3O3S
Molecular Weight339.80 g/mol
Exact Mass339.04
IUPAC Name4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCOc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1nc(C)cs1
InChIInChI=1S/C14H14ClN3O3S/c1-7-6-22-14(16-7)18-13(20)9-4-10(15)11(17-8(2)19)5-12(9)21-3/h4-6H,1-3H3,(H,17,19)(H,16,18,20)
InChIKeyJNNDYGMHTXLHQK-UHFFFAOYSA-N
XLogP3.32
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.80
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-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

4-acetamido-5-chloro-2-methoxy-N-(1,3-thiazol-2-yl)benzamide
CID 2991114
5-chloro-2-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 2304856
5-chloro-2-methoxy-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
CID 887954
5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2679160
5-chloro-N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 8511701
[2-[[4-(3,4-Difluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate
CID 16289506
[2-[N-acetyl-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]methyl 4-amino-5-chloro-2-methoxybenzoate
CID 16578293
[2-(N-acetyl-2-fluoroanilino)-1,3-thiazol-4-yl]methyl 4-amino-5-chloro-2-methoxybenzoate
CID 16578296
5-chloro-N-[4-[(4-fluorophenyl)methylsulfanylmethyl]-1,3-thiazol-2-yl]-2-methoxybenzamide
CID 16850116
[2-[[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate
CID 23905457
2-[[2-(N-acetyl-2-fluoroanilino)-1,3-thiazol-4-yl]methoxy]-5-chlorobenzamide
CID 24598882
N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-5-chloro-2-methoxybenzamide
CID 41750901

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 3350292) is 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide is COc1cc(NC(C)=O)c(Cl)cc1C(=O)Nc1nc(C)cs1.
What is the InChIKey of 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is JNNDYGMHTXLHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O3S/c1-7-6-22-14(16-7)18-13(20)9-4-10(15)11(17-8(2)19)5-12(9)21-3/h4-6H,1-3H3,(H,17,19)(H,16,18,20).
What are the key properties of 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 339.80 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 3350292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).