2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine

C111H139Cl3F8N16O12S9 — CID 160550710

IUPAC2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine
SMILESCN(C)[C@@H]1CC[C@@H](c2cccc(C(F)(F)F)c2)C[C@H]1Nc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1Cl.CN(C)[C@H]1CCCC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1C1CCC1.CN(C1CNC1)[C@H]1CCCC[C@@H]1Oc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1C1CC1.CN(CCO)[C@H]1CCCC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.Cc1csc(CS(=O)(=O)c2cc(Cl)c(N[C@H]3CCCC[C@@H]3N3CCCC3)cc2F)n1
InChIInChI=1S/C25H26ClF4N3O2S2.C23H30FN3O3S2.C22H30FN3O2S2.C21H27ClFN3O2S2.C20H26ClFN4O3S/c1-33(2)22-7-6-16(15-4-3-5-17(10-15)25(28,29)30)11-21(22)32-20-13-19(27)23(12-18(20)26)37(34,35)14-24-31-8-9-36-24;1-27(16-12-25-13-16)19-4-2-3-5-20(19)30-21-11-18(24)22(10-17(21)15-6-7-15)32(28,29)14-23-26-8-9-31-23;1-26(2)20-9-4-3-8-18(20)25-19-13-17(23)21(12-16(19)15-6-5-7-15)30(27,28)14-22-24-10-11-29-22;1-14-12-29-21(24-14)13-30(27,28)20-10-15(22)18(11-16(20)23)25-17-6-2-3-7-19(17)26-8-4-5-9-26;1-26(8-9-27)19-5-3-2-4-17(19)25-18-11-16(22)20(10-15(18)21)30(28,29)12-14-6-7-23-13-24-14/h3-5,8-10,12-13,16,21-22,32H,6-7,11,14H2,1-2H3;8-11,15-16,19-20,25H,2-7,12-14H2,1H3;10-13,15,18,20,25H,3-9,14H2,1-2H3;10-12,17,19,25H,2-9,13H2,1H3;6-7,10-11,13,17,19,25,27H,2-5,8-9,12H2,1H3/t16-,21-,22-;19-,20-;18-,20-;2*17-,19-/m10000/s1
InChIKeyQYAKXLJVNISNNH-JBISIJLFSA-N
MW2436.38 g/mol
LogP23.07
Rot. Bonds36

About 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine

2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine (PubChem CID 160550710) has the molecular formula C111H139Cl3F8N16O12S9 and a molecular weight of 2436.38 g/mol. Its IUPAC name is 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine.

Molecular Properties

Compound Name2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine
PubChem CID160550710
Molecular FormulaC111H139Cl3F8N16O12S9
Molecular Weight2436.38 g/mol
Exact Mass2432.72
IUPAC Name2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine
SMILESCN(C)[C@@H]1CC[C@@H](c2cccc(C(F)(F)F)c2)C[C@H]1Nc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1Cl.CN(C)[C@H]1CCCC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1C1CCC1.CN(C1CNC1)[C@H]1CCCC[C@@H]1Oc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1C1CC1.CN(CCO)[C@H]1CCCC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.Cc1csc(CS(=O)(=O)c2cc(Cl)c(N[C@H]3CCCC[C@@H]3N3CCCC3)cc2F)n1
InChIInChI=1S/C25H26ClF4N3O2S2.C23H30FN3O3S2.C22H30FN3O2S2.C21H27ClFN3O2S2.C20H26ClFN4O3S/c1-33(2)22-7-6-16(15-4-3-5-17(10-15)25(28,29)30)11-21(22)32-20-13-19(27)23(12-18(20)26)37(34,35)14-24-31-8-9-36-24;1-27(16-12-25-13-16)19-4-2-3-5-20(19)30-21-11-18(24)22(10-17(21)15-6-7-15)32(28,29)14-23-26-8-9-31-23;1-26(2)20-9-4-3-8-18(20)25-19-13-17(23)21(12-16(19)15-6-5-7-15)30(27,28)14-22-24-10-11-29-22;1-14-12-29-21(24-14)13-30(27,28)20-10-15(22)18(11-16(20)23)25-17-6-2-3-7-19(17)26-8-4-5-9-26;1-26(8-9-27)19-5-3-2-4-17(19)25-18-11-16(22)20(10-15(18)21)30(28,29)12-14-6-7-23-13-24-14/h3-5,8-10,12-13,16,21-22,32H,6-7,11,14H2,1-2H3;8-11,15-16,19-20,25H,2-7,12-14H2,1H3;10-13,15,18,20,25H,3-9,14H2,1-2H3;10-12,17,19,25H,2-9,13H2,1H3;6-7,10-11,13,17,19,25,27H,2-5,8-9,12H2,1H3/t16-,21-,22-;19-,20-;18-,20-;2*17-,19-/m10000/s1
InChIKeyQYAKXLJVNISNNH-JBISIJLFSA-N
XLogP23.07
TPSA353.85 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds36
Heavy Atoms159
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002436.38
LogP ≤ 523.07
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Analyze 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine?
The IUPAC name of 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine (CID 160550710) is 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine.
What is the SMILES notation for 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine?
The canonical SMILES for 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine is CN(C)[C@@H]1CC[C@@H](c2cccc(C(F)(F)F)c2)C[C@H]1Nc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1Cl.CN(C)[C@H]1CCCC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1C1CCC1.CN(C1CNC1)[C@H]1CCCC[C@@H]1Oc1cc(F)c(S(=O)(=O)Cc2nccs2)cc1C1CC1.CN(CCO)[C@H]1CCCC[C@@H]1Nc1cc(F)c(S(=O)(=O)Cc2ccncn2)cc1Cl.Cc1csc(CS(=O)(=O)c2cc(Cl)c(N[C@H]3CCCC[C@@H]3N3CCCC3)cc2F)n1.
What is the InChIKey of 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine?
The InChIKey is QYAKXLJVNISNNH-JBISIJLFSA-N. The full InChI is InChI=1S/C25H26ClF4N3O2S2.C23H30FN3O3S2.C22H30FN3O2S2.C21H27ClFN3O2S2.C20H26ClFN4O3S/c1-33(2)22-7-6-16(15-4-3-5-17(10-15)25(28,29)30)11-21(22)32-20-13-19(27)23(12-18(20)26)37(34,35)14-24-31-8-9-36-24;1-27(16-12-25-13-16)19-4-2-3-5-20(19)30-21-11-18(24)22(10-17(21)15-6-7-15)32(28,29)14-23-26-8-9-31-23;1-26(2)20-9-4-3-8-18(20)25-19-13-17(23)21(12-16(19)15-6-5-7-15)30(27,28)14-22-24-10-11-29-22;1-14-12-29-21(24-14)13-30(27,28)20-10-15(22)18(11-16(20)23)25-17-6-2-3-7-19(17)26-8-4-5-9-26;1-26(8-9-27)19-5-3-2-4-17(19)25-18-11-16(22)20(10-15(18)21)30(28,29)12-14-6-7-23-13-24-14/h3-5,8-10,12-13,16,21-22,32H,6-7,11,14H2,1-2H3;8-11,15-16,19-20,25H,2-7,12-14H2,1H3;10-13,15,18,20,25H,3-9,14H2,1-2H3;10-12,17,19,25H,2-9,13H2,1H3;6-7,10-11,13,17,19,25,27H,2-5,8-9,12H2,1H3/t16-,21-,22-;19-,20-;18-,20-;2*17-,19-/m10000/s1.
What are the key properties of 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine?
2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine has a molecular weight of 2436.38 g/mol, XLogP of 23.07, 36 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-fluoro-4-[(4-methyl-1,3-thiazol-2-yl)methylsulfonyl]-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]aniline;2-[[(1S,2S)-2-[2-chloro-5-fluoro-4-(pyrimidin-4-ylmethylsulfonyl)anilino]cyclohexyl]-methylamino]ethanol;(1R,2R,4R)-2-N-[2-chloro-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-1-N,1-N-dimethyl-4-[3-(trifluoromethyl)phenyl]cyclohexane-1,2-diamine;N-[(1S,2S)-2-[2-cyclopropyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenoxy]cyclohexyl]-N-methylazetidin-3-amine;trans-(1S,2S)-1-N-[2-cyclobutyl-5-fluoro-4-(1,3-thiazol-2-ylmethylsulfonyl)phenyl]-2-N,2-N-dimethylcyclohexane-1,2-diamine is sourced from PubChem (CID 160550710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).