N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide

C78H56Cl4F6N14O7S — CID 159070719

IUPACN-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide
SMILESCc1ncsc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Cc1occc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12)c1ccoc1.O=C(Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12)c1ccno1
InChIInChI=1S/C21H15ClF3N3O2.C20H13ClF3N3O2.C19H15ClN4OS.C18H13ClN4O2/c1-12-15(9-10-30-12)20(29)26-19-18-16(22)3-2-4-17(18)28(27-19)11-13-5-7-14(8-6-13)21(23,24)25;21-15-2-1-3-16-17(15)18(25-19(28)13-8-9-29-11-13)26-27(16)10-12-4-6-14(7-5-12)20(22,23)24;1-12-17(26-11-21-12)19(25)22-18-15-4-2-3-5-16(15)24(23-18)10-13-6-8-14(20)9-7-13;19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(22-23)21-18(24)16-9-10-20-25-16/h2-10H,11H2,1H3,(H,26,27,29);1-9,11H,10H2,(H,25,26,28);2-9,11H,10H2,1H3,(H,22,23,25);1-10H,11H2,(H,21,22,24)
InChIKeyJZPOCXBNLYFTCR-UHFFFAOYSA-N
MW1589.26 g/mol
LogP20.25
Rot. Bonds16

About N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide

N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide (PubChem CID 159070719) has the molecular formula C78H56Cl4F6N14O7S and a molecular weight of 1589.26 g/mol. Its IUPAC name is N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide
PubChem CID159070719
Molecular FormulaC78H56Cl4F6N14O7S
Molecular Weight1589.26 g/mol
Exact Mass1586.28
IUPAC NameN-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide
SMILESCc1ncsc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Cc1occc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12)c1ccoc1.O=C(Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12)c1ccno1
InChIInChI=1S/C21H15ClF3N3O2.C20H13ClF3N3O2.C19H15ClN4OS.C18H13ClN4O2/c1-12-15(9-10-30-12)20(29)26-19-18-16(22)3-2-4-17(18)28(27-19)11-13-5-7-14(8-6-13)21(23,24)25;21-15-2-1-3-16-17(15)18(25-19(28)13-8-9-29-11-13)26-27(16)10-12-4-6-14(7-5-12)20(22,23)24;1-12-17(26-11-21-12)19(25)22-18-15-4-2-3-5-16(15)24(23-18)10-13-6-8-14(20)9-7-13;19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(22-23)21-18(24)16-9-10-20-25-16/h2-10H,11H2,1H3,(H,26,27,29);1-9,11H,10H2,(H,25,26,28);2-9,11H,10H2,1H3,(H,22,23,25);1-10H,11H2,(H,21,22,24)
InChIKeyJZPOCXBNLYFTCR-UHFFFAOYSA-N
XLogP20.25
TPSA252.88 Ų
H-Bond Donors4
H-Bond Acceptors18
Rotatable Bonds16
Heavy Atoms110
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001589.26
LogP ≤ 520.25
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1018

Analyze N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide?
The IUPAC name of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide (CID 159070719) is N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide is Cc1ncsc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Cc1occc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12)c1ccoc1.O=C(Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12)c1ccno1.
What is the InChIKey of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide?
The InChIKey is JZPOCXBNLYFTCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15ClF3N3O2.C20H13ClF3N3O2.C19H15ClN4OS.C18H13ClN4O2/c1-12-15(9-10-30-12)20(29)26-19-18-16(22)3-2-4-17(18)28(27-19)11-13-5-7-14(8-6-13)21(23,24)25;21-15-2-1-3-16-17(15)18(25-19(28)13-8-9-29-11-13)26-27(16)10-12-4-6-14(7-5-12)20(22,23)24;1-12-17(26-11-21-12)19(25)22-18-15-4-2-3-5-16(15)24(23-18)10-13-6-8-14(20)9-7-13;19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(22-23)21-18(24)16-9-10-20-25-16/h2-10H,11H2,1H3,(H,26,27,29);1-9,11H,10H2,(H,25,26,28);2-9,11H,10H2,1H3,(H,22,23,25);1-10H,11H2,(H,21,22,24).
What are the key properties of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide?
N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide has a molecular weight of 1589.26 g/mol, XLogP of 20.25, 16 rotatable bonds, 4 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-methylfuran-3-carboxamide is sourced from PubChem (CID 159070719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).