5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine

C108H113Cl3F15N19O9S4 — CID 159619847

IUPAC5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine
SMILESCN(C)[C@H]1C[C@@H](c2cc(C(F)(F)F)ccc2F)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(-n3cccn3)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Nc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(C3(C(F)(F)F)CC3)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(OC(F)(F)F)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1F
InChIInChI=1S/C29H31ClF4N4O2S.C27H29ClFN7O2S.C26H26ClF5N4O2S.C26H27F5N4O3S/c1-38(2)26-13-19(18-4-3-5-20(12-18)28(9-10-28)29(32,33)34)6-7-24(26)37-25-15-23(31)27(14-22(25)30)41(39,40)16-21-8-11-35-17-36-21;1-35(2)25-14-19(18-5-3-6-20(13-18)36-12-4-10-32-36)7-8-23(25)33-24-16-22(29)26(15-21(24)28)39(37,38)34-27-9-11-30-17-31-27;1-36(2)24-9-15(18-10-16(26(30,31)32)4-5-20(18)28)3-6-22(24)35-23-12-21(29)25(11-19(23)27)39(37,38)13-17-7-8-33-14-34-17;1-35(2)24-11-17(16-4-3-5-19(10-16)38-26(29,30)31)6-7-22(24)34-23-12-21(28)25(13-20(23)27)39(36,37)14-18-8-9-32-15-33-18/h3-5,8,11-12,14-15,17,19,24,26,37H,6-7,9-10,13,16H2,1-2H3;3-6,9-13,15-17,19,23,25,33H,7-8,14H2,1-2H3,(H,30,31,34);4-5,7-8,10-12,14-15,22,24,35H,3,6,9,13H2,1-2H3;3-5,8-10,12-13,15,17,22,24,34H,6-7,11,14H2,1-2H3/t19-,24-,26-;19-,23-,25-;15-,22-,24-;17-,22-,24-/m0000/s1
InChIKeyMNTHEYMWEHDYSI-XJLLPSFQSA-N
MW2340.81 g/mol
LogP22.83
Rot. Bonds31

About 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine

5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine (PubChem CID 159619847) has the molecular formula C108H113Cl3F15N19O9S4 and a molecular weight of 2340.81 g/mol. Its IUPAC name is 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine.

Molecular Properties

Compound Name5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine
PubChem CID159619847
Molecular FormulaC108H113Cl3F15N19O9S4
Molecular Weight2340.81 g/mol
Exact Mass2337.67
IUPAC Name5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine
SMILESCN(C)[C@H]1C[C@@H](c2cc(C(F)(F)F)ccc2F)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(-n3cccn3)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Nc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(C3(C(F)(F)F)CC3)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(OC(F)(F)F)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1F
InChIInChI=1S/C29H31ClF4N4O2S.C27H29ClFN7O2S.C26H26ClF5N4O2S.C26H27F5N4O3S/c1-38(2)26-13-19(18-4-3-5-20(12-18)28(9-10-28)29(32,33)34)6-7-24(26)37-25-15-23(31)27(14-22(25)30)41(39,40)16-21-8-11-35-17-36-21;1-35(2)25-14-19(18-5-3-6-20(13-18)36-12-4-10-32-36)7-8-23(25)33-24-16-22(29)26(15-21(24)28)39(37,38)34-27-9-11-30-17-31-27;1-36(2)24-9-15(18-10-16(26(30,31)32)4-5-20(18)28)3-6-22(24)35-23-12-21(29)25(11-19(23)27)39(37,38)13-17-7-8-33-14-34-17;1-35(2)24-11-17(16-4-3-5-19(10-16)38-26(29,30)31)6-7-22(24)34-23-12-21(28)25(13-20(23)27)39(36,37)14-18-8-9-32-15-33-18/h3-5,8,11-12,14-15,17,19,24,26,37H,6-7,9-10,13,16H2,1-2H3;3-6,9-13,15-17,19,23,25,33H,7-8,14H2,1-2H3,(H,30,31,34);4-5,7-8,10-12,14-15,22,24,35H,3,6,9,13H2,1-2H3;3-5,8-10,12-13,15,17,22,24,34H,6-7,11,14H2,1-2H3/t19-,24-,26-;19-,23-,25-;15-,22-,24-;17-,22-,24-/m0000/s1
InChIKeyMNTHEYMWEHDYSI-XJLLPSFQSA-N
XLogP22.83
TPSA339.84 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds31
Heavy Atoms158
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002340.81
LogP ≤ 522.83
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine?
The IUPAC name of 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine (CID 159619847) is 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine.
What is the SMILES notation for 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine?
The canonical SMILES for 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine is CN(C)[C@H]1C[C@@H](c2cc(C(F)(F)F)ccc2F)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(-n3cccn3)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Nc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(C3(C(F)(F)F)CC3)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.CN(C)[C@H]1C[C@@H](c2cccc(OC(F)(F)F)c2)CC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1F.
What is the InChIKey of 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine?
The InChIKey is MNTHEYMWEHDYSI-XJLLPSFQSA-N. The full InChI is InChI=1S/C29H31ClF4N4O2S.C27H29ClFN7O2S.C26H26ClF5N4O2S.C26H27F5N4O3S/c1-38(2)26-13-19(18-4-3-5-20(12-18)28(9-10-28)29(32,33)34)6-7-24(26)37-25-15-23(31)27(14-22(25)30)41(39,40)16-21-8-11-35-17-36-21;1-35(2)25-14-19(18-5-3-6-20(13-18)36-12-4-10-32-36)7-8-23(25)33-24-16-22(29)26(15-21(24)28)39(37,38)34-27-9-11-30-17-31-27;1-36(2)24-9-15(18-10-16(26(30,31)32)4-5-20(18)28)3-6-22(24)35-23-12-21(29)25(11-19(23)27)39(37,38)13-17-7-8-33-14-34-17;1-35(2)24-11-17(16-4-3-5-19(10-16)38-26(29,30)31)6-7-22(24)34-23-12-21(28)25(13-20(23)27)39(36,37)14-18-8-9-32-15-33-18/h3-5,8,11-12,14-15,17,19,24,26,37H,6-7,9-10,13,16H2,1-2H3;3-6,9-13,15-17,19,23,25,33H,7-8,14H2,1-2H3,(H,30,31,34);4-5,7-8,10-12,14-15,22,24,35H,3,6,9,13H2,1-2H3;3-5,8-10,12-13,15,17,22,24,34H,6-7,11,14H2,1-2H3/t19-,24-,26-;19-,23-,25-;15-,22-,24-;17-,22-,24-/m0000/s1.
What are the key properties of 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine?
5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine has a molecular weight of 2340.81 g/mol, XLogP of 22.83, 31 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-[[(1S,2S,4S)-2-(dimethylamino)-4-(3-pyrazol-1-ylphenyl)cyclohexyl]amino]-2-fluoro-N-pyrimidin-4-ylbenzenesulfonamide;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-[1-(trifluoromethyl)cyclopropyl]phenyl]cyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-4-[2-fluoro-5-(trifluoromethyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine;(1S,2S,4S)-1-N-[2,5-difluoro-4-(pyrimidin-4-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethyl-4-[3-(trifluoromethoxy)phenyl]cyclohexane-1,2-diamine is sourced from PubChem (CID 159619847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).