4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide

C74H56ClF9N18O5S — CID 158364049

About 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide

4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide (PubChem CID 158364049) has the molecular formula C74H56ClF9N18O5S and a molecular weight of 1515.88 g/mol. Its IUPAC name is 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide.

Molecular Properties

• Compound Name: 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide
• PubChem CID: 158364049
• Molecular Formula: C74H56ClF9N18O5S
• Molecular Weight: 1515.88 g/mol
• Exact Mass: 1514.39
• IUPAC Name: 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide
• SMILES: Cc1ccc2c(NC(=O)c3scnc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.Cc1ncoc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(C#N)cc2)c2ccccc12.Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cncc(Cl)c12
• InChI: InChI=1S/C20H16F3N5OS.C20H15F3N4O2.C20H15N5O2.C14H10ClF3N4/c1-11-3-8-15-17(26-19(29)16-12(2)24-10-30-16)27-28(18(15)25-11)9-13-4-6-14(7-5-13)20(21,22)23;1-12-17(29-11-24-12)19(28)25-18-15-4-2-3-5-16(15)27(26-18)10-13-6-8-14(9-7-13)20(21,22)23;1-13-17(12-27-24-13)20(26)22-19-16-4-2-3-5-18(16)25(23-19)11-15-8-6-14(10-21)7-9-15;15-10-5-20-6-11-12(10)13(19)21-22(11)7-8-1-3-9(4-2-8)14(16,17)18/h3-8,10H,9H2,1-2H3,(H,26,27,29);2-9,11H,10H2,1H3,(H,25,26,28);2-9,12H,11H2,1H3,(H,22,23,26);1-6H,7H2,(H2,19,21)
• InChIKey: GTURTYPZTPMROE-UHFFFAOYSA-N
• XLogP: 16.72
• TPSA: 299.12 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 14
• Heavy Atoms: 108
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1515.88
LogP ≤ 5	16.72
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide?

The IUPAC name of 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide (CID 158364049) is 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide.

What is the SMILES notation for 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide?

The canonical SMILES for 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide is Cc1ccc2c(NC(=O)c3scnc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.Cc1ncoc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(C#N)cc2)c2ccccc12.Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cncc(Cl)c12.

What is the InChIKey of 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide?

The InChIKey is GTURTYPZTPMROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3N5OS.C20H15F3N4O2.C20H15N5O2.C14H10ClF3N4/c1-11-3-8-15-17(26-19(29)16-12(2)24-10-30-16)27-28(18(15)25-11)9-13-4-6-14(7-5-13)20(21,22)23;1-12-17(29-11-24-12)19(28)25-18-15-4-2-3-5-16(15)27(26-18)10-13-6-8-14(9-7-13)20(21,22)23;1-13-17(12-27-24-13)20(26)22-19-16-4-2-3-5-18(16)25(23-19)11-15-8-6-14(10-21)7-9-15;15-10-5-20-6-11-12(10)13(19)21-22(11)7-8-1-3-9(4-2-8)14(16,17)18/h3-8,10H,9H2,1-2H3,(H,26,27,29);2-9,11H,10H2,1H3,(H,25,26,28);2-9,12H,11H2,1H3,(H,22,23,26);1-6H,7H2,(H2,19,21).

What are the key properties of 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide?

4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide has a molecular weight of 1515.88 g/mol, XLogP of 16.72, 14 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[3,4-c]pyridin-3-amine;N-[1-[(4-cyanophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,3-thiazole-5-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 158364049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).