N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide

C79H59Cl2F10N13O4 — CID 158512194

IUPACN-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide
SMILESCc1ccccc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1ccc(F)cc1
InChIInChI=1S/C23H18F3N3O.C22H15F4N3O.C19H15ClN4O2.C15H11ClF3N3/c1-15-6-2-3-7-18(15)22(30)27-21-19-8-4-5-9-20(19)29(28-21)14-16-10-12-17(13-11-16)23(24,25)26;23-17-11-7-15(8-12-17)21(30)27-20-18-3-1-2-4-19(18)29(28-20)13-14-5-9-16(10-6-14)22(24,25)26;1-12-16(11-26-23-12)19(25)21-18-15-4-2-3-5-17(15)24(22-18)10-13-6-8-14(20)9-7-13;16-11-2-1-3-12-13(11)14(20)21-22(12)8-9-4-6-10(7-5-9)15(17,18)19/h2-13H,14H2,1H3,(H,27,28,30);1-12H,13H2,(H,27,28,30);2-9,11H,10H2,1H3,(H,21,22,25);1-7H,8H2,(H2,20,21)
InChIKeyHLEVJDZAOMSNPC-UHFFFAOYSA-N
MW1515.31 g/mol
LogP19.78
Rot. Bonds14

About N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide

N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide (PubChem CID 158512194) has the molecular formula C79H59Cl2F10N13O4 and a molecular weight of 1515.31 g/mol. Its IUPAC name is N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide.

Molecular Properties

Compound NameN-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide
PubChem CID158512194
Molecular FormulaC79H59Cl2F10N13O4
Molecular Weight1515.31 g/mol
Exact Mass1513.40
IUPAC NameN-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide
SMILESCc1ccccc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1ccc(F)cc1
InChIInChI=1S/C23H18F3N3O.C22H15F4N3O.C19H15ClN4O2.C15H11ClF3N3/c1-15-6-2-3-7-18(15)22(30)27-21-19-8-4-5-9-20(19)29(28-21)14-16-10-12-17(13-11-16)23(24,25)26;23-17-11-7-15(8-12-17)21(30)27-20-18-3-1-2-4-19(18)29(28-20)13-14-5-9-16(10-6-14)22(24,25)26;1-12-16(11-26-23-12)19(25)21-18-15-4-2-3-5-17(15)24(22-18)10-13-6-8-14(20)9-7-13;16-11-2-1-3-12-13(11)14(20)21-22(12)8-9-4-6-10(7-5-9)15(17,18)19/h2-13H,14H2,1H3,(H,27,28,30);1-12H,13H2,(H,27,28,30);2-9,11H,10H2,1H3,(H,21,22,25);1-7H,8H2,(H2,20,21)
InChIKeyHLEVJDZAOMSNPC-UHFFFAOYSA-N
XLogP19.78
TPSA210.63 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds14
Heavy Atoms108
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001515.31
LogP ≤ 519.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Analyze N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide with MolForge

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Related Compounds

N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide
CID 118453551
N-[4-chloro-1-[[4-(fluoromethyl)phenyl]methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide
CID 118466754
2-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;4-chloro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;N-[1-[(2-methylphenyl)methyl]indazol-3-yl]furan-3-carboxamide;6-(trifluoromethyl)-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine
CID 157523985
N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-2-methylfuran-3-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide
CID 159670149
N-[4-chloro-1-[[6-(trifluoromethyl)-3-pyridinyl]methyl]indazol-3-yl]pyridazine-3-carboxamide;2,5-difluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;1-[(4-fluorophenyl)methyl]indazol-3-amine;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide
CID 161902905
N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-2-methylfuran-3-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]furan-3-carboxamide;(2E)-N-[4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-2-(hydroxymethylidene)-3-iminobutanamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide
CID 162218091

Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide?
The IUPAC name of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide (CID 158512194) is N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide.
What is the SMILES notation for N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide?
The canonical SMILES for N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide is Cc1ccccc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(Cl)cc2)c2ccccc12.Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2cccc(Cl)c12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1ccc(F)cc1.
What is the InChIKey of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide?
The InChIKey is HLEVJDZAOMSNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18F3N3O.C22H15F4N3O.C19H15ClN4O2.C15H11ClF3N3/c1-15-6-2-3-7-18(15)22(30)27-21-19-8-4-5-9-20(19)29(28-21)14-16-10-12-17(13-11-16)23(24,25)26;23-17-11-7-15(8-12-17)21(30)27-20-18-3-1-2-4-19(18)29(28-20)13-14-5-9-16(10-6-14)22(24,25)26;1-12-16(11-26-23-12)19(25)21-18-15-4-2-3-5-17(15)24(22-18)10-13-6-8-14(20)9-7-13;16-11-2-1-3-12-13(11)14(20)21-22(12)8-9-4-6-10(7-5-9)15(17,18)19/h2-13H,14H2,1H3,(H,27,28,30);1-12H,13H2,(H,27,28,30);2-9,11H,10H2,1H3,(H,21,22,25);1-7H,8H2,(H2,20,21).
What are the key properties of N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide?
N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide has a molecular weight of 1515.31 g/mol, XLogP of 19.78, 14 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-chlorophenyl)methyl]indazol-3-yl]-3-methyl-1,2-oxazole-4-carboxamide;4-chloro-1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-amine;4-fluoro-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide;2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]benzamide is sourced from PubChem (CID 158512194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).