N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone

C130H126F14N22O11S5 — CID 157390720

About N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone

N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone (PubChem CID 157390720) has the molecular formula C130H126F14N22O11S5 and a molecular weight of 2598.89 g/mol. Its IUPAC name is N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone.

Molecular Properties

• Compound Name: N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone
• PubChem CID: 157390720
• Molecular Formula: C130H126F14N22O11S5
• Molecular Weight: 2598.89 g/mol
• Exact Mass: 2596.84
• IUPAC Name: N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone
• SMILES: C=S(=O)(c1ccc(F)cc1)N(CC1(O)CC1)[C@H]1CCC2=Cc3c(cnn3-c3ccc(F)cc3)C[C@]2(C(=O)c2cc(F)ccn2)C1.C=S(=O)(c1ccn(C)n1)N(CC(C)C)[C@H]1CCC2=Cc3c(cnn3-c3ccc(F)cc3)C[C@]2(C(=O)c2cc(F)ccn2)C1.C=S(=O)(c1ccn(C)n1)N(CC1(O)CC1)[C@H]1CCC2=Cc3c(cnn3-c3ccc(F)cc3)C[C@]2(C(=O)c2ncc(C(F)(F)F)s2)C1.CC(F)n1ccc(S(=O)(=O)N(C2CCC2)[C@H]2CCC3=Cc4c(cnn4-c4ccc(F)cc4)C[C@]3(C(=O)c3cc(C(F)(F)F)ccn3)C2)n1
• InChI: InChI=1S/C34H31F3N4O3S.C33H31F5N6O3S.C32H34F2N6O2S.C31H30F4N6O3S2/c1-45(44,29-10-5-25(36)6-11-29)40(21-33(43)13-14-33)28-7-2-23-16-31-22(20-39-41(31)27-8-3-24(35)4-9-27)18-34(23,19-28)32(42)30-17-26(37)12-15-38-30;1-20(34)42-14-12-30(41-42)48(46,47)44(26-3-2-4-26)27-8-5-22-16-29-21(19-40-43(29)25-9-6-24(35)7-10-25)17-32(22,18-27)31(45)28-15-23(11-13-39-28)33(36,37)38;1-21(2)20-39(43(4,42)30-12-14-38(3)37-30)27-8-5-23-15-29-22(19-36-40(29)26-9-6-24(33)7-10-26)17-32(23,18-27)31(41)28-16-25(34)11-13-35-28;1-39-12-9-26(38-39)46(2,44)40(18-29(43)10-11-29)23-6-3-20-13-24-19(16-37-41(24)22-7-4-21(32)5-8-22)14-30(20,15-23)27(42)28-36-17-25(45-28)31(33,34)35/h3-6,8-12,15-17,20,28,43H,1-2,7,13-14,18-19,21H2;6-7,9-16,19-20,26-27H,2-5,8,17-18H2,1H3;6-7,9-16,19,21,27H,4-5,8,17-18,20H2,1-3H3;4-5,7-9,12-13,16-17,23,43H,2-3,6,10-11,14-15,18H2,1H3/t28-,34-,45?;20?,27-,32-;27-,32-,43?;23-,30-,46?/m0000/s1
• InChIKey: BLYVXXLXUKWBCA-IUCMNLRDSA-N
• XLogP: 22.67
• TPSA: 383.35 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 30
• Rotatable Bonds: 32
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2598.89
LogP ≤ 5	22.67
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone?

The IUPAC name of N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone (CID 157390720) is N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone.

What is the SMILES notation for N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone?

The canonical SMILES for N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone is C=S(=O)(c1ccc(F)cc1)N(CC1(O)CC1)[C@H]1CCC2=Cc3c(cnn3-c3ccc(F)cc3)C[C@]2(C(=O)c2cc(F)ccn2)C1.C=S(=O)(c1ccn(C)n1)N(CC(C)C)[C@H]1CCC2=Cc3c(cnn3-c3ccc(F)cc3)C[C@]2(C(=O)c2cc(F)ccn2)C1.C=S(=O)(c1ccn(C)n1)N(CC1(O)CC1)[C@H]1CCC2=Cc3c(cnn3-c3ccc(F)cc3)C[C@]2(C(=O)c2ncc(C(F)(F)F)s2)C1.CC(F)n1ccc(S(=O)(=O)N(C2CCC2)[C@H]2CCC3=Cc4c(cnn4-c4ccc(F)cc4)C[C@]3(C(=O)c3cc(C(F)(F)F)ccn3)C2)n1.

What is the InChIKey of N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone?

The InChIKey is BLYVXXLXUKWBCA-IUCMNLRDSA-N. The full InChI is InChI=1S/C34H31F3N4O3S.C33H31F5N6O3S.C32H34F2N6O2S.C31H30F4N6O3S2/c1-45(44,29-10-5-25(36)6-11-29)40(21-33(43)13-14-33)28-7-2-23-16-31-22(20-39-41(31)27-8-3-24(35)4-9-27)18-34(23,19-28)32(42)30-17-26(37)12-15-38-30;1-20(34)42-14-12-30(41-42)48(46,47)44(26-3-2-4-26)27-8-5-22-16-29-21(19-40-43(29)25-9-6-24(35)7-10-25)17-32(22,18-27)31(45)28-15-23(11-13-39-28)33(36,37)38;1-21(2)20-39(43(4,42)30-12-14-38(3)37-30)27-8-5-23-15-29-22(19-36-40(29)26-9-6-24(33)7-10-26)17-32(23,18-27)31(41)28-16-25(34)11-13-35-28;1-39-12-9-26(38-39)46(2,44)40(18-29(43)10-11-29)23-6-3-20-13-24-19(16-37-41(24)22-7-4-21(32)5-8-22)14-30(20,15-23)27(42)28-36-17-25(45-28)31(33,34)35/h3-6,8-12,15-17,20,28,43H,1-2,7,13-14,18-19,21H2;6-7,9-16,19-20,26-27H,2-5,8,17-18H2,1H3;6-7,9-16,19,21,27H,4-5,8,17-18,20H2,1-3H3;4-5,7-9,12-13,16-17,23,43H,2-3,6,10-11,14-15,18H2,1H3/t28-,34-,45?;20?,27-,32-;27-,32-,43?;23-,30-,46?/m0000/s1.

What are the key properties of N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone?

N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone has a molecular weight of 2598.89 g/mol, XLogP of 22.67, 32 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(4aS,6S)-1-(4-fluorophenyl)-4a-[4-(trifluoromethyl)pyridine-2-carbonyl]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-6-yl]-N-cyclobutyl-1-(1-fluoroethyl)pyrazole-3-sulfonamide;[(4aS,6S)-1-(4-fluorophenyl)-6-[[(4-fluorophenyl)-methylidene-oxo-λ6-sulfanyl]-[(1-hydroxycyclopropyl)methyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[(1-hydroxycyclopropyl)methyl-[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-[5-(trifluoromethyl)-1,3-thiazol-2-yl]methanone;[(4aS,6S)-1-(4-fluorophenyl)-6-[[methylidene-(1-methylpyrazol-3-yl)-oxo-λ6-sulfanyl]-(2-methylpropyl)amino]-5,6,7,8-tetrahydro-4H-benzo[f]indazol-4a-yl]-(4-fluoro-2-pyridinyl)methanone is sourced from PubChem (CID 157390720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).