3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone

C133H117Br2F7IN25O9S3 — CID 157372625

IUPAC3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone
SMILESCC(=O)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.C[C@@H](NS(=O)(=O)N(C)C)c1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1.O=C(c1ccc(F)cc1)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.O=C(c1ccccc1I)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.O=S(=O)(NCc1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1)c1ccc(Br)cc1.O=S(=O)(NCc1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1)c1cccc(Br)c1
InChIInChI=1S/C26H22F2N4O.C26H22FIN4O.2C21H16BrFN4O2S.C21H21FN4O.C18H20FN5O2S/c27-21-5-1-18(2-6-21)24-23(17-9-13-29-14-10-17)25(31-30-24)19-11-15-32(16-12-19)26(33)20-3-7-22(28)8-4-20;27-20-7-5-18(6-8-20)24-23(17-9-13-29-14-10-17)25(31-30-24)19-11-15-32(16-12-19)26(33)21-3-1-2-4-22(21)28;22-16-3-7-18(8-4-16)30(28,29)25-13-19-20(14-9-11-24-12-10-14)21(27-26-19)15-1-5-17(23)6-2-15;22-16-2-1-3-18(12-16)30(28,29)25-13-19-20(14-8-10-24-11-9-14)21(27-26-19)15-4-6-17(23)7-5-15;1-14(27)26-12-8-17(9-13-26)21-19(15-6-10-23-11-7-15)20(24-25-21)16-2-4-18(22)5-3-16;1-12(23-27(25,26)24(2)3)17-16(13-8-10-20-11-9-13)18(22-21-17)14-4-6-15(19)7-5-14/h2*1-10,13-14,19H,11-12,15-16H2,(H,30,31);2*1-12,25H,13H2,(H,26,27);2-7,10-11,17H,8-9,12-13H2,1H3,(H,24,25);4-12,23H,1-3H3,(H,21,22)/t;;;;;12-/m.....1/s1
InChIKeyBJYDDZXYNPXNOP-UDMRDUBOSA-N
MW2725.46 g/mol
LogP27.11
Rot. Bonds29

About 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone

3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone (PubChem CID 157372625) has the molecular formula C133H117Br2F7IN25O9S3 and a molecular weight of 2725.46 g/mol. Its IUPAC name is 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone.

Molecular Properties

Compound Name3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone
PubChem CID157372625
Molecular FormulaC133H117Br2F7IN25O9S3
Molecular Weight2725.46 g/mol
Exact Mass2721.59
IUPAC Name3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone
SMILESCC(=O)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.C[C@@H](NS(=O)(=O)N(C)C)c1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1.O=C(c1ccc(F)cc1)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.O=C(c1ccccc1I)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.O=S(=O)(NCc1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1)c1ccc(Br)cc1.O=S(=O)(NCc1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1)c1cccc(Br)c1
InChIInChI=1S/C26H22F2N4O.C26H22FIN4O.2C21H16BrFN4O2S.C21H21FN4O.C18H20FN5O2S/c27-21-5-1-18(2-6-21)24-23(17-9-13-29-14-10-17)25(31-30-24)19-11-15-32(16-12-19)26(33)20-3-7-22(28)8-4-20;27-20-7-5-18(6-8-20)24-23(17-9-13-29-14-10-17)25(31-30-24)19-11-15-32(16-12-19)26(33)21-3-1-2-4-22(21)28;22-16-3-7-18(8-4-16)30(28,29)25-13-19-20(14-9-11-24-12-10-14)21(27-26-19)15-1-5-17(23)6-2-15;22-16-2-1-3-18(12-16)30(28,29)25-13-19-20(14-8-10-24-11-9-14)21(27-26-19)15-4-6-17(23)7-5-15;1-14(27)26-12-8-17(9-13-26)21-19(15-6-10-23-11-7-15)20(24-25-21)16-2-4-18(22)5-3-16;1-12(23-27(25,26)24(2)3)17-16(13-8-10-20-11-9-13)18(22-21-17)14-4-6-15(19)7-5-14/h2*1-10,13-14,19H,11-12,15-16H2,(H,30,31);2*1-12,25H,13H2,(H,26,27);2-7,10-11,17H,8-9,12-13H2,1H3,(H,24,25);4-12,23H,1-3H3,(H,21,22)/t;;;;;12-/m.....1/s1
InChIKeyBJYDDZXYNPXNOP-UDMRDUBOSA-N
XLogP27.11
TPSA452.10 Ų
H-Bond Donors9
H-Bond Acceptors21
Rotatable Bonds29
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002725.46
LogP ≤ 527.11
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

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

Analyze 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone with MolForge

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Related Compounds

4-fluoro-N-[3-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]propyl]benzamide;N-[(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethyl]-2-iodobenzamide;N-[(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethyl]-4-methylbenzenesulfonamide;N-[(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethyl]-1-phenylmethanesulfonamide;N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]-1-phenylmethanesulfonamide;propyl N-[(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethyl]carbamate;2,4,6-trifluoro-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzamide
CID 157456333
3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;(3-bromophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;3-chloro-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(4-methylphenyl)methanone
CID 157926404
(3-bromophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;3-chloro-N-[(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethyl]benzenesulfonamide;3-chloro-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[3-(4-fluorophenyl)-5-(1-methylsulfonylpiperidin-4-yl)-1H-pyrazol-4-yl]pyridine;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(4-methylphenyl)methanone;N-[3-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]propyl]cyclopropanecarboxamide
CID 159199476
3-chloro-N-[(1R)-1-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]ethyl]benzenesulfonamide;2,6-difluoro-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]-4-methylbenzamide;4-[3-(4-fluorophenyl)-5-(1-methylsulfonylpiperidin-4-yl)-1H-pyrazol-4-yl]pyridine;N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]-1-phenylmethanesulfonamide;N-[3-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]propyl]cyclopropanecarboxamide
CID 159774646

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone?
The IUPAC name of 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone (CID 157372625) is 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone.
What is the SMILES notation for 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone?
The canonical SMILES for 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone is CC(=O)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.C[C@@H](NS(=O)(=O)N(C)C)c1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1.O=C(c1ccc(F)cc1)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.O=C(c1ccccc1I)N1CCC(c2[nH]nc(-c3ccc(F)cc3)c2-c2ccncc2)CC1.O=S(=O)(NCc1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1)c1ccc(Br)cc1.O=S(=O)(NCc1[nH]nc(-c2ccc(F)cc2)c1-c1ccncc1)c1cccc(Br)c1.
What is the InChIKey of 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone?
The InChIKey is BJYDDZXYNPXNOP-UDMRDUBOSA-N. The full InChI is InChI=1S/C26H22F2N4O.C26H22FIN4O.2C21H16BrFN4O2S.C21H21FN4O.C18H20FN5O2S/c27-21-5-1-18(2-6-21)24-23(17-9-13-29-14-10-17)25(31-30-24)19-11-15-32(16-12-19)26(33)20-3-7-22(28)8-4-20;27-20-7-5-18(6-8-20)24-23(17-9-13-29-14-10-17)25(31-30-24)19-11-15-32(16-12-19)26(33)21-3-1-2-4-22(21)28;22-16-3-7-18(8-4-16)30(28,29)25-13-19-20(14-9-11-24-12-10-14)21(27-26-19)15-1-5-17(23)6-2-15;22-16-2-1-3-18(12-16)30(28,29)25-13-19-20(14-8-10-24-11-9-14)21(27-26-19)15-4-6-17(23)7-5-15;1-14(27)26-12-8-17(9-13-26)21-19(15-6-10-23-11-7-15)20(24-25-21)16-2-4-18(22)5-3-16;1-12(23-27(25,26)24(2)3)17-16(13-8-10-20-11-9-13)18(22-21-17)14-4-6-15(19)7-5-14/h2*1-10,13-14,19H,11-12,15-16H2,(H,30,31);2*1-12,25H,13H2,(H,26,27);2-7,10-11,17H,8-9,12-13H2,1H3,(H,24,25);4-12,23H,1-3H3,(H,21,22)/t;;;;;12-/m.....1/s1.
What are the key properties of 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone?
3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone has a molecular weight of 2725.46 g/mol, XLogP of 27.11, 29 rotatable bonds, 9 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-bromo-N-[[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]methyl]benzenesulfonamide;4-[5-[(1R)-1-(dimethylsulfamoylamino)ethyl]-3-(4-fluorophenyl)-1H-pyrazol-4-yl]pyridine;(4-fluorophenyl)-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]methanone;1-[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]ethanone;[4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(2-iodophenyl)methanone is sourced from PubChem (CID 157372625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).