4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride

C68H92ClN13O20S3 — CID 158262825

IUPAC4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride
SMILESCOCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)NCc4ccc(C#N)cc4)nn(C)c3C2=O)CC1.COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)O)nn(C)c3C2=O)CC1.COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)OC)nn(C)c3C2=O)CC1.Cl.N#Cc1ccc(CN)cc1
InChIInChI=1S/C25H31N5O6S.C18H27N3O7S.C17H25N3O7S.C8H8N2.ClH/c1-24(15-31,16-36-3)37(34,35)25(9-10-25)14-30-11-8-19-20(28-29(2)21(19)23(30)33)22(32)27-13-18-6-4-17(12-26)5-7-18;1-17(10-22,11-27-3)29(25,26)18(6-7-18)9-21-8-5-12-13(16(24)28-4)19-20(2)14(12)15(21)23;1-16(9-21,10-27-3)28(25,26)17(5-6-17)8-20-7-4-11-12(15(23)24)18-19(2)13(11)14(20)22;9-5-7-1-2-8(6-10)4-3-7;/h4-7,31H,8-11,13-16H2,1-3H3,(H,27,32);22H,5-11H2,1-4H3;21H,4-10H2,1-3H3,(H,23,24);1-4H,5,9H2;1H
InChIKeyWGRUUWNDLGWUDX-UHFFFAOYSA-N
MW1543.21 g/mol
LogP1.01
Rot. Bonds27

About 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride

4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride (PubChem CID 158262825) has the molecular formula C68H92ClN13O20S3 and a molecular weight of 1543.21 g/mol. Its IUPAC name is 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride.

Molecular Properties

Compound Name4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride
PubChem CID158262825
Molecular FormulaC68H92ClN13O20S3
Molecular Weight1543.21 g/mol
Exact Mass1541.54
IUPAC Name4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride
SMILESCOCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)NCc4ccc(C#N)cc4)nn(C)c3C2=O)CC1.COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)O)nn(C)c3C2=O)CC1.COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)OC)nn(C)c3C2=O)CC1.Cl.N#Cc1ccc(CN)cc1
InChIInChI=1S/C25H31N5O6S.C18H27N3O7S.C17H25N3O7S.C8H8N2.ClH/c1-24(15-31,16-36-3)37(34,35)25(9-10-25)14-30-11-8-19-20(28-29(2)21(19)23(30)33)22(32)27-13-18-6-4-17(12-26)5-7-18;1-17(10-22,11-27-3)29(25,26)18(6-7-18)9-21-8-5-12-13(16(24)28-4)19-20(2)14(12)15(21)23;1-16(9-21,10-27-3)28(25,26)17(5-6-17)8-20-7-4-11-12(15(23)24)18-19(2)13(11)14(20)22;9-5-7-1-2-8(6-10)4-3-7;/h4-7,31H,8-11,13-16H2,1-3H3,(H,27,32);22H,5-11H2,1-4H3;21H,4-10H2,1-3H3,(H,23,24);1-4H,5,9H2;1H
InChIKeyWGRUUWNDLGWUDX-UHFFFAOYSA-N
XLogP1.01
TPSA471.49 Ų
H-Bond Donors6
H-Bond Acceptors28
Rotatable Bonds27
Heavy Atoms105
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001543.21
LogP ≤ 51.01
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1028

Analyze 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride with MolForge

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Related Compounds

N-[(4-cyanophenyl)methyl]-6-[[1-[1-(1-fluoropropoxy)-2-methylpropan-2-yl]sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 160520113
4-(aminomethyl)benzonitrile;3-[1-(bromomethyl)cyclopropyl]sulfonyl-3-methyloxetane;N-[(4-cyanophenyl)methyl]-1-methyl-6-[[1-(3-methyloxetan-3-yl)sulfonylcyclopropyl]methyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;ethyl 1-methyl-7-oxo-5,6-dihydro-4H-pyrazolo[5,4-c]pyridine-3-carboxylate;1-methyl-6-[[1-(3-methyloxetan-3-yl)sulfonylcyclopropyl]methyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid
CID 158893252
tert-butyl 3-[2-[1-[[3-[(4-cyanophenyl)methylcarbamoyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]methyl]cyclopropyl]sulfonyl-2-methylpropyl]azetidine-1-carboxylate
CID 166513952
tert-butyl N-[4-[1-[[3-[(4-cyanophenyl)methylcarbamoyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]methyl]cyclopropyl]sulfonyl-4-methylpentyl]-N-methylcarbamate
CID 166513943
N-[(4-cyanophenyl)methyl]-6-[[1-[1-(3-fluoroazetidin-1-yl)-2-methylpropan-2-yl]sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;N-[(4-cyanophenyl)methyl]-1-methyl-6-[[1-(2-methyl-1-oxopropan-2-yl)sulfonylcyclopropyl]methyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 159216673
[1-[[3-[(4-cyanophenyl)methylcarbamoyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridin-6-yl]methyl]cyclopropyl] thiohypochlorite
CID 156713976
N-[(4-cyanophenyl)methyl]-6-[[1-[3-(hydroxymethyl)oxetan-3-yl]sulfinylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 156713946
6-[[1-(1,3-dihydroxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 175945997
6-[[1-(4-amino-3-hydroxy-2,4-dimethylpentan-2-yl)sulfonylcyclopropyl]methyl]-N-[(4-cyanophenyl)-phenylmethyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 175254486
N-[(4-cyanophenyl)methyl]-6-[[1-(4-hydroxy-2-methylbutan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;N-[(4-cyanophenyl)methyl]-6-[[1-(4-hydroxy-2-methylpentan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;N-[(4-cyanophenyl)methyl]-1-methyl-6-[[1-(2-methyl-4-oxobutan-2-yl)sulfonylcyclopropyl]methyl]-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;(1,1-diacetyloxy-3-oxo-1λ5,2-benziodoxol-1-yl) acetate
CID 158140762
4-[2-[1-(bromomethyl)cyclopropyl]sulfonylpropan-2-yl]-2,2-dimethyl-1,3-dioxolane;(4-chlorophenyl)methanamine;N-[(4-chlorophenyl)methyl]-6-[[1-(3,4-dihydroxy-2-methylbutan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-6-[[1-[2-(2,2-dimethyl-1,3-dioxolan-4-yl)propan-2-ylsulfonyl]cyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;ethyl 6-[[1-[2-(2,2-dimethyl-1,3-dioxolan-4-yl)propan-2-ylsulfonyl]cyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;ethyl 1-methyl-7-oxo-5,6-dihydro-4H-pyrazolo[5,4-c]pyridine-3-carboxylate
CID 158260850
1-(bromomethyl)-1-cyclopropylsulfonylcyclopropane;(4-chlorophenyl)methanamine;N-[(4-chlorophenyl)methyl]-6-[(1-cyclopropylsulfonylcyclopropyl)methyl]-1-(2-hydroxy-2-methylpropyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;ethyl 6-[(1-cyclopropylsulfonylcyclopropyl)methyl]-1-(2-hydroxy-2-methylpropyl)-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;ethyl 1-(2-hydroxy-2-methylpropyl)-7-oxo-5,6-dihydro-4H-pyrazolo[5,4-c]pyridine-3-carboxylate
CID 158755021

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride?
The IUPAC name of 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride (CID 158262825) is 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride.
What is the SMILES notation for 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride?
The canonical SMILES for 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride is COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)NCc4ccc(C#N)cc4)nn(C)c3C2=O)CC1.COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)O)nn(C)c3C2=O)CC1.COCC(C)(CO)S(=O)(=O)C1(CN2CCc3c(C(=O)OC)nn(C)c3C2=O)CC1.Cl.N#Cc1ccc(CN)cc1.
What is the InChIKey of 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride?
The InChIKey is WGRUUWNDLGWUDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31N5O6S.C18H27N3O7S.C17H25N3O7S.C8H8N2.ClH/c1-24(15-31,16-36-3)37(34,35)25(9-10-25)14-30-11-8-19-20(28-29(2)21(19)23(30)33)22(32)27-13-18-6-4-17(12-26)5-7-18;1-17(10-22,11-27-3)29(25,26)18(6-7-18)9-21-8-5-12-13(16(24)28-4)19-20(2)14(12)15(21)23;1-16(9-21,10-27-3)28(25,26)17(5-6-17)8-20-7-4-11-12(15(23)24)18-19(2)13(11)14(20)22;9-5-7-1-2-8(6-10)4-3-7;/h4-7,31H,8-11,13-16H2,1-3H3,(H,27,32);22H,5-11H2,1-4H3;21H,4-10H2,1-3H3,(H,23,24);1-4H,5,9H2;1H.
What are the key properties of 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride?
4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride has a molecular weight of 1543.21 g/mol, XLogP of 1.01, 27 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)benzonitrile;N-[(4-cyanophenyl)methyl]-6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxamide;6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylic acid;methyl 6-[[1-(1-hydroxy-3-methoxy-2-methylpropan-2-yl)sulfonylcyclopropyl]methyl]-1-methyl-7-oxo-4,5-dihydropyrazolo[5,4-c]pyridine-3-carboxylate;hydrochloride is sourced from PubChem (CID 158262825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).