5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide

C105H99Cl5N30O10 — CID 158834939

IUPAC5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
SMILESC/N=C(\N)c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CCC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CCCC1.[H]/N=C(\N)c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1
InChIInChI=1S/C23H23ClN6O2.C22H21ClN6O2.C21H19ClN6O2.C20H19ClN6O2.C19H17ClN6O2/c1-29-21(19(14-26-29)23(32)27-18-10-8-17(24)9-11-18)28-22(31)16-6-4-15(5-7-16)20(25)30-12-2-3-13-30;1-28-20(18(13-25-28)22(31)26-17-9-7-16(23)8-10-17)27-21(30)15-5-3-14(4-6-15)19(24)29-11-2-12-29;1-27-19(17(12-24-27)21(30)25-16-8-6-15(22)7-9-16)26-20(29)14-4-2-13(3-5-14)18(23)28-10-11-28;1-23-17(22)12-3-5-13(6-4-12)19(28)26-18-16(11-24-27(18)2)20(29)25-15-9-7-14(21)8-10-15;1-26-17(25-18(27)12-4-2-11(3-5-12)16(21)22)15(10-23-26)19(28)24-14-8-6-13(20)7-9-14/h4-11,14,25H,2-3,12-13H2,1H3,(H,27,32)(H,28,31);3-10,13,24H,2,11-12H2,1H3,(H,26,31)(H,27,30);2-9,12,23H,10-11H2,1H3,(H,25,30)(H,26,29);3-11H,1-2H3,(H2,22,23)(H,25,29)(H,26,28);2-10H,1H3,(H3,21,22)(H,24,28)(H,25,27)/b25-20-;24-19-;23-18-;;
InChIKeyIXNAHZVOBBOUBP-OBYBHJLSSA-N
MW2118.41 g/mol
LogP16.60
Rot. Bonds25

About 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide

5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide (PubChem CID 158834939) has the molecular formula C105H99Cl5N30O10 and a molecular weight of 2118.41 g/mol. Its IUPAC name is 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
PubChem CID158834939
Molecular FormulaC105H99Cl5N30O10
Molecular Weight2118.41 g/mol
Exact Mass2114.66
IUPAC Name5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
SMILESC/N=C(\N)c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CCC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CCCC1.[H]/N=C(\N)c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1
InChIInChI=1S/C23H23ClN6O2.C22H21ClN6O2.C21H19ClN6O2.C20H19ClN6O2.C19H17ClN6O2/c1-29-21(19(14-26-29)23(32)27-18-10-8-17(24)9-11-18)28-22(31)16-6-4-15(5-7-16)20(25)30-12-2-3-13-30;1-28-20(18(13-25-28)22(31)26-17-9-7-16(23)8-10-17)27-21(30)15-5-3-14(4-6-15)19(24)29-11-2-12-29;1-27-19(17(12-24-27)21(30)25-16-8-6-15(22)7-9-16)26-20(29)14-4-2-13(3-5-14)18(23)28-10-11-28;1-23-17(22)12-3-5-13(6-4-12)19(28)26-18-16(11-24-27(18)2)20(29)25-15-9-7-14(21)8-10-15;1-26-17(25-18(27)12-4-2-11(3-5-12)16(21)22)15(10-23-26)19(28)24-14-8-6-13(20)7-9-14/h4-11,14,25H,2-3,12-13H2,1H3,(H,27,32)(H,28,31);3-10,13,24H,2,11-12H2,1H3,(H,26,31)(H,27,30);2-9,12,23H,10-11H2,1H3,(H,25,30)(H,26,29);3-11H,1-2H3,(H2,22,23)(H,25,29)(H,26,28);2-10H,1H3,(H3,21,22)(H,24,28)(H,25,27)/b25-20-;24-19-;23-18-;;
InChIKeyIXNAHZVOBBOUBP-OBYBHJLSSA-N
XLogP16.60
TPSA549.39 Ų
H-Bond Donors16
H-Bond Acceptors25
Rotatable Bonds25
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002118.41
LogP ≤ 516.60
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide with MolForge

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Related Compounds

5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide
CID 18727771
5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide
CID 18727773
N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
CID 18728011
N-(4-chlorophenyl)-1-methyl-5-[[4-(4-methylpiperazine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(piperazine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
CID 157192088
5-[2-[4-(aziridine-1-carboximidoyl)phenyl]-2-oxoethyl]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-5-[2-(4-ethanimidoylphenyl)-2-oxoethyl]-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[2-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[2-oxo-2-[4-(piperidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide
CID 157310297
5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(5-chloro-2-pyridinyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(5-chloro-2-pyridinyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylphenyl)methylamino]-N-(5-chloro-2-pyridinyl)-1-methylpyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;hydrate
CID 157378289
5-[2-[4-(azetidine-1-carboximidoyl)phenyl]-2-oxoethyl]-N-(5-chloro-2-pyridinyl)-1-methylpyrazole-4-carboxamide;5-[2-[4-(aziridine-1-carboximidoyl)phenyl]-2-oxoethyl]-N-(5-chloro-2-pyridinyl)-1-methylpyrazole-4-carboxamide;5-[2-(4-carbamimidoylphenyl)ethyl]-N-(5-chloro-2-pyridinyl)-1-methylpyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-5-[2-(4-ethanimidoylphenyl)-2-oxoethyl]-1-methylpyrazole-4-carboxamide;N-(5-chloro-2-pyridinyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide;hydrate
CID 158044466
5-[2-[4-(azetidine-1-carboximidoyl)phenyl]-2-oxoethyl]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[2-[4-(aziridine-1-carboximidoyl)phenyl]-2-oxoethyl]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[2-(4-carbamimidoylphenyl)-2-oxoethyl]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-5-[2-(4-ethanimidoylphenyl)-2-oxoethyl]-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[2-oxo-2-[4-(pyrrolidine-1-carboximidoyl)phenyl]ethyl]pyrazole-4-carboxamide
CID 158610535
N-(4-chlorophenyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(piperazine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(thiomorpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
CID 158671784
N-(4-chlorophenyl)-1-methyl-5-[[4-(1-methyl-4,5-dihydroimidazol-2-yl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(morpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(thiomorpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
CID 158683859
5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(piperidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
CID 158686485
N-(4-chlorophenyl)-1-methyl-5-[[4-(4-methylpiperazine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(piperazine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(thiomorpholine-4-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide
CID 158922157

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide?
The IUPAC name of 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide (CID 158834939) is 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide.
What is the SMILES notation for 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide?
The canonical SMILES for 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide is C/N=C(\N)c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CCC1.[H]/N=C(/c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1)N1CCCC1.[H]/N=C(\N)c1ccc(C(=O)Nc2c(C(=O)Nc3ccc(Cl)cc3)cnn2C)cc1.
What is the InChIKey of 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide?
The InChIKey is IXNAHZVOBBOUBP-OBYBHJLSSA-N. The full InChI is InChI=1S/C23H23ClN6O2.C22H21ClN6O2.C21H19ClN6O2.C20H19ClN6O2.C19H17ClN6O2/c1-29-21(19(14-26-29)23(32)27-18-10-8-17(24)9-11-18)28-22(31)16-6-4-15(5-7-16)20(25)30-12-2-3-13-30;1-28-20(18(13-25-28)22(31)26-17-9-7-16(23)8-10-17)27-21(30)15-5-3-14(4-6-15)19(24)29-11-2-12-29;1-27-19(17(12-24-27)21(30)25-16-8-6-15(22)7-9-16)26-20(29)14-4-2-13(3-5-14)18(23)28-10-11-28;1-23-17(22)12-3-5-13(6-4-12)19(28)26-18-16(11-24-27(18)2)20(29)25-15-9-7-14(21)8-10-15;1-26-17(25-18(27)12-4-2-11(3-5-12)16(21)22)15(10-23-26)19(28)24-14-8-6-13(20)7-9-14/h4-11,14,25H,2-3,12-13H2,1H3,(H,27,32)(H,28,31);3-10,13,24H,2,11-12H2,1H3,(H,26,31)(H,27,30);2-9,12,23H,10-11H2,1H3,(H,25,30)(H,26,29);3-11H,1-2H3,(H2,22,23)(H,25,29)(H,26,28);2-10H,1H3,(H3,21,22)(H,24,28)(H,25,27)/b25-20-;24-19-;23-18-;;.
What are the key properties of 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide?
5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide has a molecular weight of 2118.41 g/mol, XLogP of 16.60, 25 rotatable bonds, 16 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(azetidine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[[4-(aziridine-1-carboximidoyl)benzoyl]amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;5-[(4-carbamimidoylbenzoyl)amino]-N-(4-chlorophenyl)-1-methylpyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(N'-methylcarbamimidoyl)benzoyl]amino]pyrazole-4-carboxamide;N-(4-chlorophenyl)-1-methyl-5-[[4-(pyrrolidine-1-carboximidoyl)benzoyl]amino]pyrazole-4-carboxamide is sourced from PubChem (CID 158834939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).