N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide

C17H12Br2Cl2N4S — CID 122509672

IUPACN-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide
SMILESBr.Cc1nc2ccc(Cl)cn2c1-c1csc(Nc2ccc(Br)cc2Cl)n1
InChIInChI=1S/C17H11BrCl2N4S.BrH/c1-9-16(24-7-11(19)3-5-15(24)21-9)14-8-25-17(23-14)22-13-4-2-10(18)6-12(13)20;/h2-8H,1H3,(H,22,23);1H
InChIKeyCUMLGWFICJABDI-UHFFFAOYSA-N
MW535.09 g/mol
LogP7.16
Rot. Bonds3

About N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide

N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide (PubChem CID 122509672) has the molecular formula C17H12Br2Cl2N4S and a molecular weight of 535.09 g/mol. Its IUPAC name is N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide.

Molecular Properties

Compound NameN-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide
PubChem CID122509672
Molecular FormulaC17H12Br2Cl2N4S
Molecular Weight535.09 g/mol
Exact Mass531.85
IUPAC NameN-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide
SMILESBr.Cc1nc2ccc(Cl)cn2c1-c1csc(Nc2ccc(Br)cc2Cl)n1
InChIInChI=1S/C17H11BrCl2N4S.BrH/c1-9-16(24-7-11(19)3-5-15(24)21-9)14-8-25-17(23-14)22-13-4-2-10(18)6-12(13)20;/h2-8H,1H3,(H,22,23);1H
InChIKeyCUMLGWFICJABDI-UHFFFAOYSA-N
XLogP7.16
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500535.09
LogP ≤ 57.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-bromo-2-chlorophenyl)-4-(6-fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine
CID 57490455
N-(2-bromo-4-methoxyphenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine
CID 57490490
4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-N-(4-ethylphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 122509701
4-(6-bromo-2-methylimidazo[1,2-a]pyridin-3-yl)-N-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-amine
CID 44603134
N-(2-chlorophenyl)-4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide
CID 126478306
4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-N-(2-methylphenyl)-1,3-thiazol-2-amine;hydrobromide
CID 126478311
N-(5-chloro-2-methoxyphenyl)-4-(2,7-dimethylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine
CID 1144673
N-(2-chlorophenyl)-4-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)-1,3-thiazol-2-amine
CID 1255043
N-(4-tert-butylphenyl)-4-(6-fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide
CID 122509774
N-(2,6-dibromo-4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine
CID 2877303
1-N-[4-(2,6-dimethylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-yl]-4-N,4-N-dimethylbenzene-1,4-diamine
CID 44602880
4-(3-chlorophenyl)-N-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
CID 53338316

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide?
The IUPAC name of N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide (CID 122509672) is N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide.
What is the SMILES notation for N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide?
The canonical SMILES for N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide is Br.Cc1nc2ccc(Cl)cn2c1-c1csc(Nc2ccc(Br)cc2Cl)n1.
What is the InChIKey of N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide?
The InChIKey is CUMLGWFICJABDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11BrCl2N4S.BrH/c1-9-16(24-7-11(19)3-5-15(24)21-9)14-8-25-17(23-14)22-13-4-2-10(18)6-12(13)20;/h2-8H,1H3,(H,22,23);1H.
What are the key properties of N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide?
N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide has a molecular weight of 535.09 g/mol, XLogP of 7.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-chlorophenyl)-4-(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-1,3-thiazol-2-amine;hydrobromide is sourced from PubChem (CID 122509672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).