5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide

C140H124Cl7FN32O10S2 — CID 159022412

IUPAC5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide
SMILESCOc1ccc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)c(C)c1C.COc1ccc(F)cc1/C=N/c1n[nH]c(Cc2cccc(Cl)c2)c1C(N)=O.Cc1cc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)cc(C)c1C.Cc1ccc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)cn1.Cc1ccc(Oc2ccc(/C=N/c3n[nH]c(Cc4cccc(Cl)c4)c3C(N)=O)cc2)nc1.Cc1ncsc1/C=N/c1n[nH]c(Cc2cccc(Cl)c2)c1C(N)=O.NC(=O)c1c(/N=C/c2ccc(-c3ccccn3)s2)n[nH]c1Cc1cccc(Cl)c1
InChIInChI=1S/C24H20ClN5O2.C21H16ClN5OS.C21H21ClN4O2.C21H21ClN4O.C19H16ClFN4O2.C18H16ClN5O.C16H14ClN5OS/c1-15-5-10-21(27-13-15)32-19-8-6-16(7-9-19)14-28-24-22(23(26)31)20(29-30-24)12-17-3-2-4-18(25)11-17;22-14-5-3-4-13(10-14)11-17-19(20(23)28)21(27-26-17)25-12-15-7-8-18(29-15)16-6-1-2-9-24-16;1-12-13(2)18(28-3)8-7-15(12)11-24-21-19(20(23)27)17(25-26-21)10-14-5-4-6-16(22)9-14;1-12-7-16(8-13(2)14(12)3)11-24-21-19(20(23)27)18(25-26-21)10-15-5-4-6-17(22)9-15;1-27-16-6-5-14(21)9-12(16)10-23-19-17(18(22)26)15(24-25-19)8-11-3-2-4-13(20)7-11;1-11-5-6-13(9-21-11)10-22-18-16(17(20)25)15(23-24-18)8-12-3-2-4-14(19)7-12;1-9-13(24-8-20-9)7-19-16-14(15(18)23)12(21-22-16)6-10-3-2-4-11(17)5-10/h2-11,13-14H,12H2,1H3,(H2,26,31)(H,29,30);1-10,12H,11H2,(H2,23,28)(H,26,27);4-9,11H,10H2,1-3H3,(H2,23,27)(H,25,26);4-9,11H,10H2,1-3H3,(H2,23,27)(H,25,26);2-7,9-10H,8H2,1H3,(H2,22,26)(H,24,25);2-7,9-10H,8H2,1H3,(H2,20,25)(H,23,24);2-5,7-8H,6H2,1H3,(H2,18,23)(H,21,22)/b28-14+;25-12+;2*24-11+;23-10+;22-10+;19-7+
InChIKeyJTWDBCNRIHPSJE-JIBGWWNQSA-N
MW2746.05 g/mol
LogP28.31
Rot. Bonds40

About 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide

5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide (PubChem CID 159022412) has the molecular formula C140H124Cl7FN32O10S2 and a molecular weight of 2746.05 g/mol. Its IUPAC name is 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide
PubChem CID159022412
Molecular FormulaC140H124Cl7FN32O10S2
Molecular Weight2746.05 g/mol
Exact Mass2740.74
IUPAC Name5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide
SMILESCOc1ccc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)c(C)c1C.COc1ccc(F)cc1/C=N/c1n[nH]c(Cc2cccc(Cl)c2)c1C(N)=O.Cc1cc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)cc(C)c1C.Cc1ccc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)cn1.Cc1ccc(Oc2ccc(/C=N/c3n[nH]c(Cc4cccc(Cl)c4)c3C(N)=O)cc2)nc1.Cc1ncsc1/C=N/c1n[nH]c(Cc2cccc(Cl)c2)c1C(N)=O.NC(=O)c1c(/N=C/c2ccc(-c3ccccn3)s2)n[nH]c1Cc1cccc(Cl)c1
InChIInChI=1S/C24H20ClN5O2.C21H16ClN5OS.C21H21ClN4O2.C21H21ClN4O.C19H16ClFN4O2.C18H16ClN5O.C16H14ClN5OS/c1-15-5-10-21(27-13-15)32-19-8-6-16(7-9-19)14-28-24-22(23(26)31)20(29-30-24)12-17-3-2-4-18(25)11-17;22-14-5-3-4-13(10-14)11-17-19(20(23)28)21(27-26-17)25-12-15-7-8-18(29-15)16-6-1-2-9-24-16;1-12-13(2)18(28-3)8-7-15(12)11-24-21-19(20(23)27)17(25-26-21)10-14-5-4-6-16(22)9-14;1-12-7-16(8-13(2)14(12)3)11-24-21-19(20(23)27)18(25-26-21)10-15-5-4-6-17(22)9-15;1-27-16-6-5-14(21)9-12(16)10-23-19-17(18(22)26)15(24-25-19)8-11-3-2-4-13(20)7-11;1-11-5-6-13(9-21-11)10-22-18-16(17(20)25)15(23-24-18)8-12-3-2-4-14(19)7-12;1-9-13(24-8-20-9)7-19-16-14(15(18)23)12(21-22-16)6-10-3-2-4-11(17)5-10/h2-11,13-14H,12H2,1H3,(H2,26,31)(H,29,30);1-10,12H,11H2,(H2,23,28)(H,26,27);4-9,11H,10H2,1-3H3,(H2,23,27)(H,25,26);4-9,11H,10H2,1-3H3,(H2,23,27)(H,25,26);2-7,9-10H,8H2,1H3,(H2,22,26)(H,24,25);2-7,9-10H,8H2,1H3,(H2,20,25)(H,23,24);2-5,7-8H,6H2,1H3,(H2,18,23)(H,21,22)/b28-14+;25-12+;2*24-11+;23-10+;22-10+;19-7+
InChIKeyJTWDBCNRIHPSJE-JIBGWWNQSA-N
XLogP28.31
TPSA668.16 Ų
H-Bond Donors14
H-Bond Acceptors30
Rotatable Bonds40
Heavy Atoms192
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002746.05
LogP ≤ 528.31
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 157055410
CID 157055410
CID 160822482
CID 160822482
CID 161210432
CID 161210432
5-[(3-chlorophenyl)methyl]-3-[(2,6-dihydroxy-4-methylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3-ethyl-2-hydroxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(2-hydroxy-5-methylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(2-hydroxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[3-methoxy-4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[2-methoxy-5-(trifluoromethyl)phenyl]methylideneamino]-1H-pyrazole-4-carboxamide
CID 162156800
5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-pyrimidin-2-yloxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(2-thiophen-2-ylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide
CID 158340376
5-[(3-chlorophenyl)methyl]-3-[(2,6-dihydroxy-4-methylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3-ethyl-2-hydroxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(2-hydroxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(2-methoxy-5-methylphenyl)methylamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[3-methoxy-4-[(2-methyl-1,3-thiazol-5-yl)methoxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide
CID 158625801
5-[(3-chlorophenyl)methyl]-3-[(2,4-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carbonitrile;5-[(3-chlorophenyl)methyl]-3-[(2-hydroxy-4-methylphenyl)methylideneamino]-1H-pyrazole-4-carbonitrile;5-[(3-chlorophenyl)methyl]-3-[(6-methoxy-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carbonitrile;5-[(3-chlorophenyl)methyl]-3-[(4-methylphenyl)methylideneamino]-1H-pyrazole-4-carbonitrile;5-[(3-chlorophenyl)methyl]-3-[(2-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carbonitrile;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carbonitrile
CID 161859915

Frequently Asked Questions

What is the IUPAC name of 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide (CID 159022412) is 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide is COc1ccc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)c(C)c1C.COc1ccc(F)cc1/C=N/c1n[nH]c(Cc2cccc(Cl)c2)c1C(N)=O.Cc1cc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)cc(C)c1C.Cc1ccc(/C=N/c2n[nH]c(Cc3cccc(Cl)c3)c2C(N)=O)cn1.Cc1ccc(Oc2ccc(/C=N/c3n[nH]c(Cc4cccc(Cl)c4)c3C(N)=O)cc2)nc1.Cc1ncsc1/C=N/c1n[nH]c(Cc2cccc(Cl)c2)c1C(N)=O.NC(=O)c1c(/N=C/c2ccc(-c3ccccn3)s2)n[nH]c1Cc1cccc(Cl)c1.
What is the InChIKey of 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide?
The InChIKey is JTWDBCNRIHPSJE-JIBGWWNQSA-N. The full InChI is InChI=1S/C24H20ClN5O2.C21H16ClN5OS.C21H21ClN4O2.C21H21ClN4O.C19H16ClFN4O2.C18H16ClN5O.C16H14ClN5OS/c1-15-5-10-21(27-13-15)32-19-8-6-16(7-9-19)14-28-24-22(23(26)31)20(29-30-24)12-17-3-2-4-18(25)11-17;22-14-5-3-4-13(10-14)11-17-19(20(23)28)21(27-26-17)25-12-15-7-8-18(29-15)16-6-1-2-9-24-16;1-12-13(2)18(28-3)8-7-15(12)11-24-21-19(20(23)27)17(25-26-21)10-14-5-4-6-16(22)9-14;1-12-7-16(8-13(2)14(12)3)11-24-21-19(20(23)27)18(25-26-21)10-15-5-4-6-17(22)9-15;1-27-16-6-5-14(21)9-12(16)10-23-19-17(18(22)26)15(24-25-19)8-11-3-2-4-13(20)7-11;1-11-5-6-13(9-21-11)10-22-18-16(17(20)25)15(23-24-18)8-12-3-2-4-14(19)7-12;1-9-13(24-8-20-9)7-19-16-14(15(18)23)12(21-22-16)6-10-3-2-4-11(17)5-10/h2-11,13-14H,12H2,1H3,(H2,26,31)(H,29,30);1-10,12H,11H2,(H2,23,28)(H,26,27);4-9,11H,10H2,1-3H3,(H2,23,27)(H,25,26);4-9,11H,10H2,1-3H3,(H2,23,27)(H,25,26);2-7,9-10H,8H2,1H3,(H2,22,26)(H,24,25);2-7,9-10H,8H2,1H3,(H2,20,25)(H,23,24);2-5,7-8H,6H2,1H3,(H2,18,23)(H,21,22)/b28-14+;25-12+;2*24-11+;23-10+;22-10+;19-7+.
What are the key properties of 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide?
5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide has a molecular weight of 2746.05 g/mol, XLogP of 28.31, 40 rotatable bonds, 14 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-chlorophenyl)methyl]-3-[(5-fluoro-2-methoxyphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methoxy-2,3-dimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(6-methyl-3-pyridinyl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[[4-[(5-methyl-2-pyridinyl)oxy]phenyl]methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(4-methyl-1,3-thiazol-5-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(5-pyridin-2-ylthiophen-2-yl)methylideneamino]-1H-pyrazole-4-carboxamide;5-[(3-chlorophenyl)methyl]-3-[(3,4,5-trimethylphenyl)methylideneamino]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 159022412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).