4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide

C15H10ClN3OS — CID 3462248

IUPAC4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1ccc(Cl)cc1
InChIInChI=1S/C15H10ClN3OS/c16-11-6-4-10(5-7-11)14(20)19-15-18-13(9-21-15)12-3-1-2-8-17-12/h1-9H,(H,18,19,20)
InChIKeyVCQWELBLOBIXGT-UHFFFAOYSA-N
MW315.79 g/mol
LogP4.11
Rot. Bonds3

About 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide

4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide (PubChem CID 3462248) has the molecular formula C15H10ClN3OS and a molecular weight of 315.79 g/mol. Its IUPAC name is 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
PubChem CID3462248
Molecular FormulaC15H10ClN3OS
Molecular Weight315.79 g/mol
Exact Mass315.02
IUPAC Name4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nc(-c2ccccn2)cs1)c1ccc(Cl)cc1
InChIInChI=1S/C15H10ClN3OS/c16-11-6-4-10(5-7-11)14(20)19-15-18-13(9-21-15)12-3-1-2-8-17-12/h1-9H,(H,18,19,20)
InChIKeyVCQWELBLOBIXGT-UHFFFAOYSA-N
XLogP4.11
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.79
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-N-(4-pyridin-2-yl-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

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide (CID 3462248) is 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide is O=C(Nc1nc(-c2ccccn2)cs1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
The InChIKey is VCQWELBLOBIXGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3OS/c16-11-6-4-10(5-7-11)14(20)19-15-18-13(9-21-15)12-3-1-2-8-17-12/h1-9H,(H,18,19,20).
What are the key properties of 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide?
4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide has a molecular weight of 315.79 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 3462248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).