4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide

C18H14ClN3O2S — CID 7923619

IUPAC4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1
InChIInChI=1S/C18H14ClN3O2S/c1-11(23)20-15-8-4-13(5-9-15)17(24)22-18-21-16(10-25-18)12-2-6-14(19)7-3-12/h2-10H,1H3,(H,20,23)(H,21,22,24)
InChIKeyHWXDMLQDQCMPGX-UHFFFAOYSA-N
MW371.85 g/mol
LogP4.67
Rot. Bonds4

About 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide

4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide (PubChem CID 7923619) has the molecular formula C18H14ClN3O2S and a molecular weight of 371.85 g/mol. Its IUPAC name is 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide.

Molecular Properties

Compound Name4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide
PubChem CID7923619
Molecular FormulaC18H14ClN3O2S
Molecular Weight371.85 g/mol
Exact Mass371.05
IUPAC Name4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide
SMILESCC(=O)Nc1ccc(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1
InChIInChI=1S/C18H14ClN3O2S/c1-11(23)20-15-8-4-13(5-9-15)17(24)22-18-21-16(10-25-18)12-2-6-14(19)7-3-12/h2-10H,1H3,(H,20,23)(H,21,22,24)
InChIKeyHWXDMLQDQCMPGX-UHFFFAOYSA-N
XLogP4.67
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.85
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-acetamido-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2463728
4-acetamido-N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]benzamide
CID 2090772
N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-4-chlorobenzamide
CID 42568023
4-chloro-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]benzamide
CID 2332435
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 55649325
4-acetamido-N-[4-(2,5-dichlorophenyl)-1,3-thiazol-2-yl]benzamide
CID 30731933
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-4-[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]phenoxy]benzamide
CID 3542120
4-acetamido-N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]benzamide
CID 4844502
4-[[4-[4-[(4-chlorobenzoyl)amino]phenyl]-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid
CID 1111396
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-(difluoromethoxy)benzamide
CID 2441454
N-[[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]methyl]-4-chlorobenzamide
CID 110351814
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-4-(ethylsulfanylmethyl)benzamide
CID 52694784

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
The IUPAC name of 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide (CID 7923619) is 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide.
What is the SMILES notation for 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
The canonical SMILES for 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide is CC(=O)Nc1ccc(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1.
What is the InChIKey of 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
The InChIKey is HWXDMLQDQCMPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN3O2S/c1-11(23)20-15-8-4-13(5-9-15)17(24)22-18-21-16(10-25-18)12-2-6-14(19)7-3-12/h2-10H,1H3,(H,20,23)(H,21,22,24).
What are the key properties of 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide has a molecular weight of 371.85 g/mol, XLogP of 4.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]benzamide is sourced from PubChem (CID 7923619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).