4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole

C78H57Cl3F6N10OS5 — CID 159061813

IUPAC4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole
SMILESCOc1cccc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.Clc1cccc(-c2csc(Nc3ccccn3)n2)c1.Clc1cccc(-c2csc(Nc3cccnc3)n2)c1.FC(F)(F)c1cccc(Cc2nc(-c3ccc(Cl)cc3)cs2)c1.c1ccc(Nc2nc(-c3ccccc3)cs2)cc1
InChIInChI=1S/C18H14F3NOS.C17H11ClF3NS.C15H12N2S.2C14H10ClN3S/c1-23-15-7-3-5-13(10-15)16-11-24-17(22-16)9-12-4-2-6-14(8-12)18(19,20)21;18-14-6-4-12(5-7-14)15-10-23-16(22-15)9-11-2-1-3-13(8-11)17(19,20)21;1-3-7-12(8-4-1)14-11-18-15(17-14)16-13-9-5-2-6-10-13;15-11-4-1-3-10(7-11)13-9-19-14(18-13)17-12-5-2-6-16-8-12;15-11-5-3-4-10(8-11)12-9-19-14(17-12)18-13-6-1-2-7-16-13/h2-8,10-11H,9H2,1H3;1-8,10H,9H2;1-11H,(H,16,17);1-9H,(H,17,18);1-9H,(H,16,17,18)
InChIKeyJYOIWMOMZGVOJJ-UHFFFAOYSA-N
MW1531.06 g/mol
LogP25.26
Rot. Bonds16

About 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole

4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole (PubChem CID 159061813) has the molecular formula C78H57Cl3F6N10OS5 and a molecular weight of 1531.06 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole.

Molecular Properties

Compound Name4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole
PubChem CID159061813
Molecular FormulaC78H57Cl3F6N10OS5
Molecular Weight1531.06 g/mol
Exact Mass1528.23
IUPAC Name4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole
SMILESCOc1cccc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.Clc1cccc(-c2csc(Nc3ccccn3)n2)c1.Clc1cccc(-c2csc(Nc3cccnc3)n2)c1.FC(F)(F)c1cccc(Cc2nc(-c3ccc(Cl)cc3)cs2)c1.c1ccc(Nc2nc(-c3ccccc3)cs2)cc1
InChIInChI=1S/C18H14F3NOS.C17H11ClF3NS.C15H12N2S.2C14H10ClN3S/c1-23-15-7-3-5-13(10-15)16-11-24-17(22-16)9-12-4-2-6-14(8-12)18(19,20)21;18-14-6-4-12(5-7-14)15-10-23-16(22-15)9-11-2-1-3-13(8-11)17(19,20)21;1-3-7-12(8-4-1)14-11-18-15(17-14)16-13-9-5-2-6-10-13;15-11-4-1-3-10(7-11)13-9-19-14(18-13)17-12-5-2-6-16-8-12;15-11-5-3-4-10(8-11)12-9-19-14(17-12)18-13-6-1-2-7-16-13/h2-8,10-11H,9H2,1H3;1-8,10H,9H2;1-11H,(H,16,17);1-9H,(H,17,18);1-9H,(H,16,17,18)
InChIKeyJYOIWMOMZGVOJJ-UHFFFAOYSA-N
XLogP25.26
TPSA135.55 Ų
H-Bond Donors3
H-Bond Acceptors16
Rotatable Bonds16
Heavy Atoms103
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001531.06
LogP ≤ 525.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1016

Analyze 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole with MolForge

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Related Compounds

4-[2-[6-(7-azabicyclo[2.2.1]heptan-7-yl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;4-[2-[6-(2-fluoro-3-methoxyphenyl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;4-[2-[6-(4-fluoro-3-methylphenyl)-3-pyridinyl]ethynyl]-2-methyl-1,3-thiazole;2-methyl-4-[2-[6-(3-methylphenyl)-3-pyridinyl]ethynyl]-1,3-thiazole;N-methyl-5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-N-pyridin-2-ylpyridin-2-amine
CID 161250219
4-Chloro-2-methylaniline;5-(3-chlorophenyl)-2,4-dimethyl-1,3-thiazole;5-(4-chlorophenyl)-2,4-dimethyl-1,3-thiazole;5-(3,5-difluorophenyl)-2,4-dimethyl-1,3-thiazole;2,4-dimethylaniline;2,5-dimethylaniline;3-(2,4-dimethylphenyl)iminoprop-1-en-1-amine;2,4-dimethyl-5-phenyl-1,3-thiazole;2,6-dimethylpyridin-3-amine;nonakis(ethane-1,2-diimine);3-fluoro-2,4-dimethylaniline;3-fluoro-4-methoxy-2-methylaniline;5-(4-fluorophenyl)-2,4-dimethyl-1,3-thiazole;4-methoxy-2-methylaniline;5-(6-methoxy-3-pyridinyl)-2,4-dimethyl-1,3-thiazole;2-methylaniline;1-methyl-2-(4-methylphenyl)benzene;2,4,5-trimethylaniline
CID 161901094
2-[4-(3-chlorophenyl)-2-[4-(4-chlorophenyl)-3-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-2H-1,3-thiazol-5-yl]-1,3-thiazol-5-yl]-5-phenyl-4-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-thiazole
CID 173203305

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole?
The IUPAC name of 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole (CID 159061813) is 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole.
What is the SMILES notation for 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole?
The canonical SMILES for 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole is COc1cccc(-c2csc(Cc3cccc(C(F)(F)F)c3)n2)c1.Clc1cccc(-c2csc(Nc3ccccn3)n2)c1.Clc1cccc(-c2csc(Nc3cccnc3)n2)c1.FC(F)(F)c1cccc(Cc2nc(-c3ccc(Cl)cc3)cs2)c1.c1ccc(Nc2nc(-c3ccccc3)cs2)cc1.
What is the InChIKey of 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole?
The InChIKey is JYOIWMOMZGVOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3NOS.C17H11ClF3NS.C15H12N2S.2C14H10ClN3S/c1-23-15-7-3-5-13(10-15)16-11-24-17(22-16)9-12-4-2-6-14(8-12)18(19,20)21;18-14-6-4-12(5-7-14)15-10-23-16(22-15)9-11-2-1-3-13(8-11)17(19,20)21;1-3-7-12(8-4-1)14-11-18-15(17-14)16-13-9-5-2-6-10-13;15-11-4-1-3-10(7-11)13-9-19-14(18-13)17-12-5-2-6-16-8-12;15-11-5-3-4-10(8-11)12-9-19-14(17-12)18-13-6-1-2-7-16-13/h2-8,10-11H,9H2,1H3;1-8,10H,9H2;1-11H,(H,16,17);1-9H,(H,17,18);1-9H,(H,16,17,18).
What are the key properties of 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole?
4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole has a molecular weight of 1531.06 g/mol, XLogP of 25.26, 16 rotatable bonds, 3 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine;4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine;4-(4-chlorophenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole;N,4-diphenyl-1,3-thiazol-2-amine;4-(3-methoxyphenyl)-2-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazole is sourced from PubChem (CID 159061813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).