1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane

C101H107Br4N27O6S — CID 159756383

IUPAC1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane
SMILESC.CC(C)(O)CC(=O)N1CCC(c2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N)c2Br)CC1.CC(C)NC(=O)N1CCC(c2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N)c2Br)CC1.NC(=O)N1CCC(c2nc3c(-c4ccc(-c5cccnc5)nc4)cnn3c(N)c2Br)CC1.Nc1c(Br)c(C2CCN(S(=O)(=O)C3CC3)CC2)nc2c(-c3ccc(-c4ccccc4)nc3)cnn12
InChIInChI=1S/C27H29BrN6O2.C26H28BrN7O.C25H25BrN6O2S.C22H21BrN8O.CH4/c1-27(2,36)14-22(35)33-12-10-18(11-13-33)24-23(28)25(29)34-26(32-24)20(16-31-34)19-8-9-21(30-15-19)17-6-4-3-5-7-17;1-16(2)31-26(35)33-12-10-18(11-13-33)23-22(27)24(28)34-25(32-23)20(15-30-34)19-8-9-21(29-14-19)17-6-4-3-5-7-17;26-22-23(17-10-12-31(13-11-17)35(33,34)19-7-8-19)30-25-20(15-29-32(25)24(22)27)18-6-9-21(28-14-18)16-4-2-1-3-5-16;23-18-19(13-5-8-30(9-6-13)22(25)32)29-21-16(12-28-31(21)20(18)24)14-3-4-17(27-11-14)15-2-1-7-26-10-15;/h3-9,15-16,18,36H,10-14,29H2,1-2H3;3-9,14-16,18H,10-13,28H2,1-2H3,(H,31,35);1-6,9,14-15,17,19H,7-8,10-13,27H2;1-4,7,10-13H,5-6,8-9,24H2,(H2,25,32);1H4
InChIKeyNEHVVDFCNZRWDP-UHFFFAOYSA-N
MW2146.83 g/mol
LogP18.34
Rot. Bonds17

About 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane

1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane (PubChem CID 159756383) has the molecular formula C101H107Br4N27O6S and a molecular weight of 2146.83 g/mol. Its IUPAC name is 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane.

Molecular Properties

Compound Name1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane
PubChem CID159756383
Molecular FormulaC101H107Br4N27O6S
Molecular Weight2146.83 g/mol
Exact Mass2141.54
IUPAC Name1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane
SMILESC.CC(C)(O)CC(=O)N1CCC(c2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N)c2Br)CC1.CC(C)NC(=O)N1CCC(c2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N)c2Br)CC1.NC(=O)N1CCC(c2nc3c(-c4ccc(-c5cccnc5)nc4)cnn3c(N)c2Br)CC1.Nc1c(Br)c(C2CCN(S(=O)(=O)C3CC3)CC2)nc2c(-c3ccc(-c4ccccc4)nc3)cnn12
InChIInChI=1S/C27H29BrN6O2.C26H28BrN7O.C25H25BrN6O2S.C22H21BrN8O.CH4/c1-27(2,36)14-22(35)33-12-10-18(11-13-33)24-23(28)25(29)34-26(32-24)20(16-31-34)19-8-9-21(30-15-19)17-6-4-3-5-7-17;1-16(2)31-26(35)33-12-10-18(11-13-33)23-22(27)24(28)34-25(32-23)20(15-30-34)19-8-9-21(29-14-19)17-6-4-3-5-7-17;26-22-23(17-10-12-31(13-11-17)35(33,34)19-7-8-19)30-25-20(15-29-32(25)24(22)27)18-6-9-21(28-14-18)16-4-2-1-3-5-16;23-18-19(13-5-8-30(9-6-13)22(25)32)29-21-16(12-28-31(21)20(18)24)14-3-4-17(27-11-14)15-2-1-7-26-10-15;/h3-9,15-16,18,36H,10-14,29H2,1-2H3;3-9,14-16,18H,10-13,28H2,1-2H3,(H,31,35);1-6,9,14-15,17,19H,7-8,10-13,27H2;1-4,7,10-13H,5-6,8-9,24H2,(H2,25,32);1H4
InChIKeyNEHVVDFCNZRWDP-UHFFFAOYSA-N
XLogP18.34
TPSA445.88 Ų
H-Bond Donors7
H-Bond Acceptors27
Rotatable Bonds17
Heavy Atoms139
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002146.83
LogP ≤ 518.34
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1027

Analyze 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane with MolForge

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Related Compounds

4-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)piperazin-2-one;N-[[1-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-4-yl]methyl]methanesulfonamide;1-[1-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-4-yl]pyrrolidin-2-one;6-bromo-5-(6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-quinolin-3-yl-5-[2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-yl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 159054750
1-[4-[3-Bromo-7-[[6-[[3-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]sulfonylmethyl]-3-pyridinyl]methylamino]pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanone
CID 142871366
3-bromo-5-(1-methylsulfonylpiperidin-3-yl)-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;1-[4-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanone;ethane;piperidine
CID 143090100
3-bromo-5-(1-methylsulfonylpiperidin-3-yl)-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;1-[4-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanone;ethane;N-methyl-N-prop-1-en-2-ylbutan-1-amine
CID 143090121
3-bromo-5-(1-methylsulfonylpiperidin-3-yl)-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;4-bromopyrazol-1-id-5-amine;1-[4-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanone;carbanide;ethane;methanol;N-methyl-N-prop-1-en-2-ylbutan-1-amine;yttrium
CID 145502473
N-[4-[[[3-bromo-5-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]pyrazolo[1,5-a]pyrimidin-7-yl]amino]methyl]phenyl]cyclopropanecarboxamide;[(1S,2S)-2-[[3-bromo-7-[(1-methylpyridin-1-ium-3-yl)methylamino]pyrazolo[1,5-a]pyrimidin-5-yl]methyl]cyclohexyl]methanol;2-[(2S)-1-[3-bromo-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyrimidin-5-yl]pyrrolidin-2-yl]ethanol;methane
CID 157107801
CID 157319381
CID 157319381
2-amino-1-[4-[7-amino-6-bromo-3-(1-phenylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]ethanone;4-[7-amino-6-bromo-3-(1-phenylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;4-[7-amino-6-bromo-3-(1-phenylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxylic acid;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(1-phenylpyrrol-3-yl)pyrazolo[1,5-a]pyrimidin-7-amine;6-bromo-3-(1-phenylpyrrol-3-yl)-5-[1-(1H-1,2,4-triazol-5-ylsulfonyl)piperidin-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine;methane
CID 157328382
4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-ethylpiperidine-1-carboxamide;4-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-N-ethylpiperidine-1-carboxamide;6-bromo-5-(1-propylsulfonylpiperidin-4-yl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;ethyl 4-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate;methyl 4-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)piperidine-1-carboxylate
CID 157742225
4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-ethylpiperidine-1-carboxamide;[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carbonyl]carbamic acid;2-[4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]sulfonylethanol;6-bromo-3-(6-phenyl-3-pyridinyl)-5-[1-(1H-1,2,4-triazol-5-ylsulfonyl)piperidin-4-yl]pyrazolo[1,5-a]pyrimidin-7-amine;methane
CID 157828062
2-amino-1-[4-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]ethanone;3-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-N-ethylpyrrolidine-1-carboxamide;4-[(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)methyl]-N-methylpiperidine-1-carboxamide;4-(7-amino-6-bromo-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-5-yl)-N-methylpiperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-quinolin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 157893500
4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-methylpiperidine-1-carboxamide;1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-2-(hydroxymethyl)-2-methylpropan-1-one;(2S)-3-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]propane-1,2-diol;(2R)-1-[4-[7-amino-6-bromo-3-(2-phenylpyrimidin-5-yl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-2,3-dihydroxypropan-1-one
CID 157913314

Frequently Asked Questions

What is the IUPAC name of 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane?
The IUPAC name of 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane (CID 159756383) is 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane.
What is the SMILES notation for 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane?
The canonical SMILES for 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane is C.CC(C)(O)CC(=O)N1CCC(c2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N)c2Br)CC1.CC(C)NC(=O)N1CCC(c2nc3c(-c4ccc(-c5ccccc5)nc4)cnn3c(N)c2Br)CC1.NC(=O)N1CCC(c2nc3c(-c4ccc(-c5cccnc5)nc4)cnn3c(N)c2Br)CC1.Nc1c(Br)c(C2CCN(S(=O)(=O)C3CC3)CC2)nc2c(-c3ccc(-c4ccccc4)nc3)cnn12.
What is the InChIKey of 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane?
The InChIKey is NEHVVDFCNZRWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29BrN6O2.C26H28BrN7O.C25H25BrN6O2S.C22H21BrN8O.CH4/c1-27(2,36)14-22(35)33-12-10-18(11-13-33)24-23(28)25(29)34-26(32-24)20(16-31-34)19-8-9-21(30-15-19)17-6-4-3-5-7-17;1-16(2)31-26(35)33-12-10-18(11-13-33)23-22(27)24(28)34-25(32-23)20(15-30-34)19-8-9-21(29-14-19)17-6-4-3-5-7-17;26-22-23(17-10-12-31(13-11-17)35(33,34)19-7-8-19)30-25-20(15-29-32(25)24(22)27)18-6-9-21(28-14-18)16-4-2-1-3-5-16;23-18-19(13-5-8-30(9-6-13)22(25)32)29-21-16(12-28-31(21)20(18)24)14-3-4-17(27-11-14)15-2-1-7-26-10-15;/h3-9,15-16,18,36H,10-14,29H2,1-2H3;3-9,14-16,18H,10-13,28H2,1-2H3,(H,31,35);1-6,9,14-15,17,19H,7-8,10-13,27H2;1-4,7,10-13H,5-6,8-9,24H2,(H2,25,32);1H4.
What are the key properties of 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane?
1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane has a molecular weight of 2146.83 g/mol, XLogP of 18.34, 17 rotatable bonds, 7 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one;4-[7-amino-6-bromo-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]-N-propan-2-ylpiperidine-1-carboxamide;4-[7-amino-6-bromo-3-(6-pyridin-3-yl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-yl]piperidine-1-carboxamide;6-bromo-5-(1-cyclopropylsulfonylpiperidin-4-yl)-3-(6-phenyl-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-7-amine;methane is sourced from PubChem (CID 159756383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).