1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol

C164H223N37O29S5 — CID 158562915

About 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol

1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol (PubChem CID 158562915) has the molecular formula C164H223N37O29S5 and a molecular weight of 3337.15 g/mol. Its IUPAC name is 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol.

Molecular Properties

• Compound Name: 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
• PubChem CID: 158562915
• Molecular Formula: C164H223N37O29S5
• Molecular Weight: 3337.15 g/mol
• Exact Mass: 3334.57
• IUPAC Name: 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol
• SMILES: CC[C@@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(=O)(=O)CC.CC[C@@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(C)(=O)=O.CC[C@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(=O)(=O)CC.CC[C@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(C)(=O)=O.CNCC(O)COc1cccc(-c2nc(-c3c(C)noc3C)c(C)c(N3CCO[C@H](CN(C)C)C3)n2)c1.CNC[C@@H](O)COc1cccc(-c2nc(-c3c(C)noc3C)c(C)c(-c3cn(S(C)(=O)=O)c4ncncc34)n2)c1
• InChI: InChI=1S/2C28H40N6O5S.C27H29N7O5S.2C27H38N6O5S.C27H38N6O4/c2*1-7-22-16-33(12-13-34(22)40(36,37)8-2)28-18(3)26(25-19(4)32-39-20(25)5)30-27(31-28)21-10-9-11-24(14-21)38-17-23(35)15-29-6;1-15-24(22-12-34(40(5,36)37)27-21(22)11-29-14-30-27)31-26(32-25(15)23-16(2)33-39-17(23)3)18-7-6-8-20(9-18)38-13-19(35)10-28-4;2*1-7-21-15-32(11-12-33(21)39(6,35)36)27-17(2)25(24-18(3)31-38-19(24)4)29-26(30-27)20-9-8-10-23(13-20)37-16-22(34)14-28-5;1-17-25(24-18(2)31-37-19(24)3)29-26(20-8-7-9-22(12-20)36-16-21(34)13-28-4)30-27(17)33-10-11-35-23(15-33)14-32(5)6/h2*9-11,14,22-23,29,35H,7-8,12-13,15-17H2,1-6H3;6-9,11-12,14,19,28,35H,10,13H2,1-5H3;2*8-10,13,21-22,28,34H,7,11-12,14-16H2,1-6H3;7-9,12,21,23,28,34H,10-11,13-16H2,1-6H3/t2*22-,23?;19-;2*21-,22?;21?,23-/m101101/s1
• InChIKey: HRCLNSNUUBFXQL-WRJSIYMASA-N
• XLogP: 16.30
• TPSA: 802.84 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 62
• Rotatable Bonds: 61
• Heavy Atoms: 235
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3337.15
LogP ≤ 5	16.30
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	62

Frequently Asked Questions

What is the IUPAC name of 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?

The IUPAC name of 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol (CID 158562915) is 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol.

What is the SMILES notation for 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?

The canonical SMILES for 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol is CC[C@@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(=O)(=O)CC.CC[C@@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(C)(=O)=O.CC[C@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(=O)(=O)CC.CC[C@H]1CN(c2nc(-c3cccc(OCC(O)CNC)c3)nc(-c3c(C)noc3C)c2C)CCN1S(C)(=O)=O.CNCC(O)COc1cccc(-c2nc(-c3c(C)noc3C)c(C)c(N3CCO[C@H](CN(C)C)C3)n2)c1.CNC[C@@H](O)COc1cccc(-c2nc(-c3c(C)noc3C)c(C)c(-c3cn(S(C)(=O)=O)c4ncncc34)n2)c1.

What is the InChIKey of 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?

The InChIKey is HRCLNSNUUBFXQL-WRJSIYMASA-N. The full InChI is InChI=1S/2C28H40N6O5S.C27H29N7O5S.2C27H38N6O5S.C27H38N6O4/c2*1-7-22-16-33(12-13-34(22)40(36,37)8-2)28-18(3)26(25-19(4)32-39-20(25)5)30-27(31-28)21-10-9-11-24(14-21)38-17-23(35)15-29-6;1-15-24(22-12-34(40(5,36)37)27-21(22)11-29-14-30-27)31-26(32-25(15)23-16(2)33-39-17(23)3)18-7-6-8-20(9-18)38-13-19(35)10-28-4;2*1-7-21-15-32(11-12-33(21)39(6,35)36)27-17(2)25(24-18(3)31-38-19(24)4)29-26(30-27)20-9-8-10-23(13-20)37-16-22(34)14-28-5;1-17-25(24-18(2)31-37-19(24)3)29-26(20-8-7-9-22(12-20)36-16-21(34)13-28-4)30-27(17)33-10-11-35-23(15-33)14-32(5)6/h2*9-11,14,22-23,29,35H,7-8,12-13,15-17H2,1-6H3;6-9,11-12,14,19,28,35H,10,13H2,1-5H3;2*8-10,13,21-22,28,34H,7,11-12,14-16H2,1-6H3;7-9,12,21,23,28,34H,10-11,13-16H2,1-6H3/t2*22-,23?;19-;2*21-,22?;21?,23-/m101101/s1.

What are the key properties of 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol?

1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol has a molecular weight of 3337.15 g/mol, XLogP of 16.30, 61 rotatable bonds, 12 hydrogen bond donors, and 62 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[3-[4-[(2R)-2-[(dimethylamino)methyl]morpholin-4-yl]-6-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-ethylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3R)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-6-[(3S)-3-ethyl-4-methylsulfonylpiperazin-1-yl]-5-methylpyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol;(2R)-1-[3-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-5-methyl-6-(7-methylsulfonylpyrrolo[2,3-d]pyrimidin-5-yl)pyrimidin-2-yl]phenoxy]-3-(methylamino)propan-2-ol is sourced from PubChem (CID 158562915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).