6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane

C143H199Cl2N21O29S4 — CID 158893131

About 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane

6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane (PubChem CID 158893131) has the molecular formula C143H199Cl2N21O29S4 and a molecular weight of 2875.46 g/mol. Its IUPAC name is 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane.

Molecular Properties

• Compound Name: 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane
• PubChem CID: 158893131
• Molecular Formula: C143H199Cl2N21O29S4
• Molecular Weight: 2875.46 g/mol
• Exact Mass: 2872.30
• IUPAC Name: 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane
• SMILES: CC(=O)N1CCC(Nc2cc(C(=O)CC[C@H](O)CN3CCc4cc(OCc5conc5C)ccc4C3)ncn2)CC1.CC(=O)N1CCC(Nc2cc(C(=O)O)ncn2)CC1.CC(C)(C)OC(=O)CC[C@H](O)CCl.CC(C)(C)OC(=O)N1CCc2cc(O)ccc2C1.Cc1nocc1CCl.Cc1nocc1COc1ccc2c(c1)CCN(C(=O)OC(C)(C)C)C2.Cc1nocc1COc1ccc2c(c1)CCN(C[C@@H](O)CCC(=O)OC(C)(C)C)C2.Cc1nocc1COc1ccc2c(c1)CCN(C[C@@H](O)CN)C2.Cc1nocc1COc1ccc2c(c1)CCNC2.S.S.S.S
• InChI: InChI=1S/C30H38N6O5.C23H32N2O5.C19H24N2O4.C17H23N3O3.C14H16N2O2.C14H19NO3.C12H16N4O3.C9H17ClO3.C5H6ClNO.4H2S/c1-20-24(18-41-34-20)17-40-27-5-3-23-15-35(10-7-22(23)13-27)16-26(38)4-6-29(39)28-14-30(32-19-31-28)33-25-8-11-36(12-9-25)21(2)37;1-16-19(15-29-24-16)14-28-21-7-5-18-12-25(10-9-17(18)11-21)13-20(26)6-8-22(27)30-23(2,3)4;1-13-16(12-24-20-13)11-23-17-6-5-15-10-21(8-7-14(15)9-17)18(22)25-19(2,3)4;1-12-15(11-23-19-12)10-22-17-3-2-14-8-20(9-16(21)7-18)5-4-13(14)6-17;1-10-13(9-18-16-10)8-17-14-3-2-12-7-15-5-4-11(12)6-14;1-14(2,3)18-13(17)15-7-6-10-8-12(16)5-4-11(10)9-15;1-8(17)16-4-2-9(3-5-16)15-11-6-10(12(18)19)13-7-14-11;1-9(2,3)13-8(12)5-4-7(11)6-10;1-4-5(2-6)3-8-7-4;;;;/h3,5,13-14,18-19,25-26,38H,4,6-12,15-17H2,1-2H3,(H,31,32,33);5,7,11,15,20,26H,6,8-10,12-14H2,1-4H3;5-6,9,12H,7-8,10-11H2,1-4H3;2-3,6,11,16,21H,4-5,7-10,18H2,1H3;2-3,6,9,15H,4-5,7-8H2,1H3;4-5,8,16H,6-7,9H2,1-3H3;6-7,9H,2-5H2,1H3,(H,18,19)(H,13,14,15);7,11H,4-6H2,1-3H3;3H,2H2,1H3;4*1H2/t26-;20-;;16-;;;;7-;;;;;/m00.0...0...../s1
• InChIKey: JEMHSZDCTHFXOV-HOWCAZNGSA-N
• XLogP: 21.03
• TPSA: 633.54 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 45
• Rotatable Bonds: 39
• Heavy Atoms: 199
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2875.46
LogP ≤ 5	21.03
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane?

The IUPAC name of 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane (CID 158893131) is 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane.

What is the SMILES notation for 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane?

The canonical SMILES for 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane is CC(=O)N1CCC(Nc2cc(C(=O)CC[C@H](O)CN3CCc4cc(OCc5conc5C)ccc4C3)ncn2)CC1.CC(=O)N1CCC(Nc2cc(C(=O)O)ncn2)CC1.CC(C)(C)OC(=O)CC[C@H](O)CCl.CC(C)(C)OC(=O)N1CCc2cc(O)ccc2C1.Cc1nocc1CCl.Cc1nocc1COc1ccc2c(c1)CCN(C(=O)OC(C)(C)C)C2.Cc1nocc1COc1ccc2c(c1)CCN(C[C@@H](O)CCC(=O)OC(C)(C)C)C2.Cc1nocc1COc1ccc2c(c1)CCN(C[C@@H](O)CN)C2.Cc1nocc1COc1ccc2c(c1)CCNC2.S.S.S.S.

What is the InChIKey of 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane?

The InChIKey is JEMHSZDCTHFXOV-HOWCAZNGSA-N. The full InChI is InChI=1S/C30H38N6O5.C23H32N2O5.C19H24N2O4.C17H23N3O3.C14H16N2O2.C14H19NO3.C12H16N4O3.C9H17ClO3.C5H6ClNO.4H2S/c1-20-24(18-41-34-20)17-40-27-5-3-23-15-35(10-7-22(23)13-27)16-26(38)4-6-29(39)28-14-30(32-19-31-28)33-25-8-11-36(12-9-25)21(2)37;1-16-19(15-29-24-16)14-28-21-7-5-18-12-25(10-9-17(18)11-21)13-20(26)6-8-22(27)30-23(2,3)4;1-13-16(12-24-20-13)11-23-17-6-5-15-10-21(8-7-14(15)9-17)18(22)25-19(2,3)4;1-12-15(11-23-19-12)10-22-17-3-2-14-8-20(9-16(21)7-18)5-4-13(14)6-17;1-10-13(9-18-16-10)8-17-14-3-2-12-7-15-5-4-11(12)6-14;1-14(2,3)18-13(17)15-7-6-10-8-12(16)5-4-11(10)9-15;1-8(17)16-4-2-9(3-5-16)15-11-6-10(12(18)19)13-7-14-11;1-9(2,3)13-8(12)5-4-7(11)6-10;1-4-5(2-6)3-8-7-4;;;;/h3,5,13-14,18-19,25-26,38H,4,6-12,15-17H2,1-2H3,(H,31,32,33);5,7,11,15,20,26H,6,8-10,12-14H2,1-4H3;5-6,9,12H,7-8,10-11H2,1-4H3;2-3,6,11,16,21H,4-5,7-10,18H2,1H3;2-3,6,9,15H,4-5,7-8H2,1H3;4-5,8,16H,6-7,9H2,1-3H3;6-7,9H,2-5H2,1H3,(H,18,19)(H,13,14,15);7,11H,4-6H2,1-3H3;3H,2H2,1H3;4*1H2/t26-;20-;;16-;;;;7-;;;;;/m00.0...0...../s1.

What are the key properties of 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane?

6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane has a molecular weight of 2875.46 g/mol, XLogP of 21.03, 39 rotatable bonds, 10 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(1-acetylpiperidin-4-yl)amino]pyrimidine-4-carboxylic acid;(4S)-1-[6-[(1-acetylpiperidin-4-yl)amino]pyrimidin-4-yl]-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentan-1-one;(2S)-1-amino-3-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]propan-2-ol;tert-butyl (4S)-5-chloro-4-hydroxypentanoate;tert-butyl 6-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylate;tert-butyl (4S)-4-hydroxy-5-[6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinolin-2-yl]pentanoate;tert-butyl 6-[(3-methyl-1,2-oxazol-4-yl)methoxy]-3,4-dihydro-1H-isoquinoline-2-carboxylate;4-(chloromethyl)-3-methyl-1,2-oxazole;3-methyl-4-(1,2,3,4-tetrahydroisoquinolin-6-yloxymethyl)-1,2-oxazole;sulfane is sourced from PubChem (CID 158893131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).