4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine

C16H13ClN2OS — CID 689163

IUPAC4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccccc1Nc1nc(-c2ccc(Cl)cc2)cs1
InChIInChI=1S/C16H13ClN2OS/c1-20-15-5-3-2-4-13(15)18-16-19-14(10-21-16)11-6-8-12(17)9-7-11/h2-10H,1H3,(H,18,19)
InChIKeyWVOGAKJZTLJNSB-UHFFFAOYSA-N
MW316.81 g/mol
LogP5.22
Rot. Bonds4

About 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine

4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine (PubChem CID 689163) has the molecular formula C16H13ClN2OS and a molecular weight of 316.81 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
PubChem CID689163
Molecular FormulaC16H13ClN2OS
Molecular Weight316.81 g/mol
Exact Mass316.04
IUPAC Name4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine
SMILESCOc1ccccc1Nc1nc(-c2ccc(Cl)cc2)cs1
InChIInChI=1S/C16H13ClN2OS/c1-20-15-5-3-2-4-13(15)18-16-19-14(10-21-16)11-6-8-12(17)9-7-11/h2-10H,1H3,(H,18,19)
InChIKeyWVOGAKJZTLJNSB-UHFFFAOYSA-N
XLogP5.22
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.81
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-((4-(4-Chlorophenyl)-2-thiazolyl)amino)phenol
CID 753704
N-aryl-4-aryl-1,3-thiazole-2-amine, 9
CID 25100738
(5-Chloro-2-methoxy-phenyl)-(4-pyridin-3-yl-thiazol-2-yl)-amine
CID 800782
4-(4-methoxyphenyl)-N-phenyl-1,3-thiazol-2-amine
CID 698943
N-(4-methoxyphenyl)-4-phenyl-1,3-thiazol-2-amine
CID 1548457
N-(2-methoxyphenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-amine hydrobromide
CID 16681989
1-(4-(4-Methoxyphenyl)thiazol-2-yl)-3-phenylurea
CID 930415
4-(4-methoxyphenyl)-N-(4-methylphenyl)-1,3-thiazol-2-amine
CID 4521790
4-(4-chlorophenyl)-N-(4-methoxyphenyl)thiazol-2-amine
CID 768022
N-(4-phenoxyphenyl)-4-phenyl-1,3-thiazol-2-amine
CID 873121
N~2~-(5-chloro-2-methoxyphenyl)-4'-methyl-4,5'-bi-1,3-thiazole-2,2'-diamine
CID 1144668
4-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]-1,3-thiazol-2-amine
CID 4149421

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine (CID 689163) is 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine is COc1ccccc1Nc1nc(-c2ccc(Cl)cc2)cs1.
What is the InChIKey of 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
The InChIKey is WVOGAKJZTLJNSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2OS/c1-20-15-5-3-2-4-13(15)18-16-19-14(10-21-16)11-6-8-12(17)9-7-11/h2-10H,1H3,(H,18,19).
What are the key properties of 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine?
4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine has a molecular weight of 316.81 g/mol, XLogP of 5.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-N-(2-methoxyphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 689163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).