About N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate
N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate (PubChem CID 158371772) has the molecular formula C90H80F4N22O17S4
and a molecular weight of 1946.03 g/mol. Its IUPAC name is N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate.
Frequently Asked Questions
What is the IUPAC name of N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate?
The IUPAC name of N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate (CID 158371772) is N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate.
What is the SMILES notation for N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate?
The canonical SMILES for N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate is CNC(=O)C[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.COC(=O)C[C@H](NC(=O)c1cncc2c1cnn2-c1ccc(F)cc1)c1ccnc(S(C)(=O)=O)c1.CS(=O)(=O)c1cc([C@H](CC(N)=O)NC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)ccn1.CS(=O)(=O)c1cc([C@H](CCO)NC(=O)c2cncc3c2cnn3-c2ccc(F)cc2)ccn1.
What is the InChIKey of N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate?
The InChIKey is GURURUGGCKWMDX-DWQKPVPHSA-N. The full InChI is InChI=1S/C23H21FN6O4S.C23H20FN5O5S.C22H19FN6O4S.C22H20FN5O4S/c1-25-21(31)10-19(14-7-8-27-22(9-14)35(2,33)34)29-23(32)18-11-26-13-20-17(18)12-28-30(20)16-5-3-15(24)4-6-16;1-34-22(30)10-19(14-7-8-26-21(9-14)35(2,32)33)28-23(31)18-11-25-13-20-17(18)12-27-29(20)16-5-3-15(24)4-6-16;1-34(32,33)21-8-13(6-7-26-21)18(9-20(24)30)28-22(31)17-10-25-12-19-16(17)11-27-29(19)15-4-2-14(23)3-5-15;1-33(31,32)21-10-14(6-8-25-21)19(7-9-29)27-22(30)18-11-24-13-20-17(18)12-26-28(20)16-4-2-15(23)3-5-16/h3-9,11-13,19H,10H2,1-2H3,(H,25,31)(H,29,32);3-9,11-13,19H,10H2,1-2H3,(H,28,31);2-8,10-12,18H,9H2,1H3,(H2,24,30)(H,28,31);2-6,8,10-13,19,29H,7,9H2,1H3,(H,27,30)/t2*19-;18-;19-/m0000/s1.
What are the key properties of N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate?
N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate has a molecular weight of 1946.03 g/mol, XLogP of 8.27, 28 rotatable bonds, 7 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-3-amino-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]-1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-hydroxy-1-(2-methylsulfonyl-4-pyridinyl)propyl]pyrazolo[5,4-c]pyridine-4-carboxamide;1-(4-fluorophenyl)-N-[(1S)-3-(methylamino)-1-(2-methylsulfonyl-4-pyridinyl)-3-oxopropyl]pyrazolo[5,4-c]pyridine-4-carboxamide;methyl (3S)-3-[[1-(4-fluorophenyl)pyrazolo[5,4-c]pyridine-4-carbonyl]amino]-3-(2-methylsulfonyl-4-pyridinyl)propanoate is sourced from PubChem (CID 158371772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).