bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine

C143H110Cl10F8N16S13 — CID 159325997

About bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine

bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine (PubChem CID 159325997) has the molecular formula C143H110Cl10F8N16S13 and a molecular weight of 2975.95 g/mol. Its IUPAC name is bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

• Compound Name: bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine
• PubChem CID: 159325997
• Molecular Formula: C143H110Cl10F8N16S13
• Molecular Weight: 2975.95 g/mol
• Exact Mass: 2968.22
• IUPAC Name: bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine
• SMILES: CNc1nc(-c2ccc(F)cc2F)cs1.Cc1nc(-c2ccc(Cl)c(Cl)c2)cs1.Cc1nc(-c2ccc(Cl)cc2)cs1.Cc1nc(-c2ccc(Cl)cc2)cs1.Cc1nc(-c2ccc(Cl)cc2Cl)cs1.Cc1nc(-c2ccc(Cl)cc2Cl)cs1.Cc1nc(-c2ccc(Cl)cc2Cl)cs1.Cc1nc(-c2ccc(F)cc2)cs1.Cc1nc(-c2ccc(F)cc2)cs1.Cc1nc(-c2ccc(F)cc2F)cs1.Cc1nc(-c2ccc3ccccc3c2)cs1.Cc1nc(-c2ccccc2)cs1.Fc1ccc(C2=CCC=N2)c(F)c1.Nc1nc(-c2ccccc2)cs1
• InChI: InChI=1S/C14H11NS.4C10H7Cl2NS.2C10H8ClNS.C10H8F2N2S.C10H7F2NS.C10H7F2N.2C10H8FNS.C10H9NS.C9H8N2S/c1-10-15-14(9-16-10)13-7-6-11-4-2-3-5-12(11)8-13;3*1-6-13-10(5-14-6)8-3-2-7(11)4-9(8)12;1-6-13-10(5-14-6)7-2-3-8(11)9(12)4-7;2*1-7-12-10(6-13-7)8-2-4-9(11)5-3-8;1-13-10-14-9(5-15-10)7-3-2-6(11)4-8(7)12;1-6-13-10(5-14-6)8-3-2-7(11)4-9(8)12;11-7-3-4-8(9(12)6-7)10-2-1-5-13-10;2*1-7-12-10(6-13-7)8-2-4-9(11)5-3-8;1-8-11-10(7-12-8)9-5-3-2-4-6-9;10-9-11-8(6-12-9)7-4-2-1-3-5-7/h2-9H,1H3;4*2-5H,1H3;2*2-6H,1H3;2-5H,1H3,(H,13,14);2-5H,1H3;2-6H,1H2;2*2-6H,1H3;2-7H,1H3;1-6H,(H2,10,11)
• InChIKey: LEJIDMXWDQWQOU-UHFFFAOYSA-N
• XLogP: 50.85
• TPSA: 217.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 29
• Rotatable Bonds: 15
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2975.95
LogP ≤ 5	50.85
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine?

The IUPAC name of bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine (CID 159325997) is bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine.

What is the SMILES notation for bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine?

The canonical SMILES for bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine is CNc1nc(-c2ccc(F)cc2F)cs1.Cc1nc(-c2ccc(Cl)c(Cl)c2)cs1.Cc1nc(-c2ccc(Cl)cc2)cs1.Cc1nc(-c2ccc(Cl)cc2)cs1.Cc1nc(-c2ccc(Cl)cc2Cl)cs1.Cc1nc(-c2ccc(Cl)cc2Cl)cs1.Cc1nc(-c2ccc(Cl)cc2Cl)cs1.Cc1nc(-c2ccc(F)cc2)cs1.Cc1nc(-c2ccc(F)cc2)cs1.Cc1nc(-c2ccc(F)cc2F)cs1.Cc1nc(-c2ccc3ccccc3c2)cs1.Cc1nc(-c2ccccc2)cs1.Fc1ccc(C2=CCC=N2)c(F)c1.Nc1nc(-c2ccccc2)cs1.

What is the InChIKey of bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine?

The InChIKey is LEJIDMXWDQWQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NS.4C10H7Cl2NS.2C10H8ClNS.C10H8F2N2S.C10H7F2NS.C10H7F2N.2C10H8FNS.C10H9NS.C9H8N2S/c1-10-15-14(9-16-10)13-7-6-11-4-2-3-5-12(11)8-13;3*1-6-13-10(5-14-6)8-3-2-7(11)4-9(8)12;1-6-13-10(5-14-6)7-2-3-8(11)9(12)4-7;2*1-7-12-10(6-13-7)8-2-4-9(11)5-3-8;1-13-10-14-9(5-15-10)7-3-2-6(11)4-8(7)12;1-6-13-10(5-14-6)8-3-2-7(11)4-9(8)12;11-7-3-4-8(9(12)6-7)10-2-1-5-13-10;2*1-7-12-10(6-13-7)8-2-4-9(11)5-3-8;1-8-11-10(7-12-8)9-5-3-2-4-6-9;10-9-11-8(6-12-9)7-4-2-1-3-5-7/h2-9H,1H3;4*2-5H,1H3;2*2-6H,1H3;2-5H,1H3,(H,13,14);2-5H,1H3;2-6H,1H2;2*2-6H,1H3;2-7H,1H3;1-6H,(H2,10,11).

What are the key properties of bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine?

bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine has a molecular weight of 2975.95 g/mol, XLogP of 50.85, 15 rotatable bonds, 2 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for bis(4-(4-chlorophenyl)-2-methyl-1,3-thiazole);tris(4-(2,4-dichlorophenyl)-2-methyl-1,3-thiazole);4-(3,4-dichlorophenyl)-2-methyl-1,3-thiazole;4-(2,4-difluorophenyl)-N-methyl-1,3-thiazol-2-amine;4-(2,4-difluorophenyl)-2-methyl-1,3-thiazole;5-(2,4-difluorophenyl)-3H-pyrrole;bis(4-(4-fluorophenyl)-2-methyl-1,3-thiazole);2-methyl-4-naphthalen-2-yl-1,3-thiazole;2-methyl-4-phenyl-1,3-thiazole;4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 159325997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).