4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide

C15H16Cl2N4OS — CID 145420154

IUPAC4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESCc1ccc(N2CCN(C(=O)Nc3ncc(Cl)s3)CC2)cc1Cl
InChIInChI=1S/C15H16Cl2N4OS/c1-10-2-3-11(8-12(10)16)20-4-6-21(7-5-20)15(22)19-14-18-9-13(17)23-14/h2-3,8-9H,4-7H2,1H3,(H,18,19,22)
InChIKeyCWAFTKVJKWUXNJ-UHFFFAOYSA-N
MW371.29 g/mol
LogP4.11
Rot. Bonds2

About 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide

4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide (PubChem CID 145420154) has the molecular formula C15H16Cl2N4OS and a molecular weight of 371.29 g/mol. Its IUPAC name is 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide
PubChem CID145420154
Molecular FormulaC15H16Cl2N4OS
Molecular Weight371.29 g/mol
Exact Mass370.04
IUPAC Name4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide
SMILESCc1ccc(N2CCN(C(=O)Nc3ncc(Cl)s3)CC2)cc1Cl
InChIInChI=1S/C15H16Cl2N4OS/c1-10-2-3-11(8-12(10)16)20-4-6-21(7-5-20)15(22)19-14-18-9-13(17)23-14/h2-3,8-9H,4-7H2,1H3,(H,18,19,22)
InChIKeyCWAFTKVJKWUXNJ-UHFFFAOYSA-N
XLogP4.11
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.29
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-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

4-(3-chloro-4-methylphenyl)-N-(5-cyano-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 145420088
4-(3,4-dichlorophenyl)-N-(5-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 145420100
N-(5-cyano-1,3-thiazol-2-yl)-4-(3,4-dichlorophenyl)piperazine-1-carboxamide
CID 145420109
4-(4-chloro-3-methylphenyl)-N-(5-cyano-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 145420119
4-(3-chloro-4-methylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 145420120
4-(4-chloro-3-methylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 145420130
4-(4-chloro-3-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 145420137
3-(4-chloro-3-methylanilino)-N-(5-chloro-1,3-thiazol-2-yl)pyrrolidine-1-carboxamide
CID 145420144
N-(5-chloro-1,3-thiazol-2-yl)-4-(3,4-dichlorophenyl)piperazine-1-carboxamide
CID 145420156
1-(3-Chloro-4-methyl-phenyl)-3-(5-chloro-thiazol-2-yl)-1-cyclopentylmethyl-urea
CID 44389882
3-(3-chloro-4-methylanilino)-N-(5-chloro-1,3-thiazol-2-yl)azetidine-1-carboxamide
CID 162660985
4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)-3-methylpiperazine-1-carboxamide
CID 162662550

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide?
The IUPAC name of 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide (CID 145420154) is 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide is Cc1ccc(N2CCN(C(=O)Nc3ncc(Cl)s3)CC2)cc1Cl.
What is the InChIKey of 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide?
The InChIKey is CWAFTKVJKWUXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Cl2N4OS/c1-10-2-3-11(8-12(10)16)20-4-6-21(7-5-20)15(22)19-14-18-9-13(17)23-14/h2-3,8-9H,4-7H2,1H3,(H,18,19,22).
What are the key properties of 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide?
4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide has a molecular weight of 371.29 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-4-methylphenyl)-N-(5-chloro-1,3-thiazol-2-yl)piperazine-1-carboxamide is sourced from PubChem (CID 145420154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).