(1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one

C199H179Cl6N17O19S6 — CID 157225651

About (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one

(1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one (PubChem CID 157225651) has the molecular formula C199H179Cl6N17O19S6 and a molecular weight of 3517.84 g/mol. Its IUPAC name is (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one.

Molecular Properties

• Compound Name: (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one
• PubChem CID: 157225651
• Molecular Formula: C199H179Cl6N17O19S6
• Molecular Weight: 3517.84 g/mol
• Exact Mass: 3512.00
• IUPAC Name: (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one
• SMILES: CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccc4c(c3)OCCO4)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccnc(-c4ccc5cc[nH]c(=O)c5c4)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccnc(-c4ccc5ccn(C)c(=O)c5c4)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccnc(-n4ccc5ncccc5c4=O)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-n3ccc4cnccc4c3=O)sc2c1-c1ccc(Cl)cc1.COC1C=Cc2ccc(-c3cc(-c4nc5cc(C)c([C@H](OC(C)(C)C)C(C)=O)c(-c6ccc(Cl)cc6)c5s4)ccn3)cc2N1
• InChI: InChI=1S/C36H34ClN3O3S.C36H32ClN3O3S.C35H30ClN3O3S.C34H29ClN4O3S.C29H26ClN3O3S.C29H28ClNO4S/c1-20-17-29-34(32(23-9-12-26(37)13-10-23)31(20)33(21(2)41)43-36(3,4)5)44-35(40-29)25-15-16-38-27(19-25)24-8-7-22-11-14-30(42-6)39-28(22)18-24;1-20-17-29-33(31(23-9-11-26(37)12-10-23)30(20)32(21(2)41)43-36(3,4)5)44-34(39-29)25-13-15-38-28(19-25)24-8-7-22-14-16-40(6)35(42)27(22)18-24;1-19-16-28-32(30(22-8-10-25(36)11-9-22)29(19)31(20(2)40)42-35(3,4)5)43-34(39-28)24-13-14-37-27(18-24)23-7-6-21-12-15-38-33(41)26(21)17-23;1-19-17-26-31(29(21-8-10-23(35)11-9-21)28(19)30(20(2)40)42-34(3,4)5)43-32(38-26)22-12-15-37-27(18-22)39-16-13-25-24(33(39)41)7-6-14-36-25;1-16-14-22-26(37-28(32-22)33-13-11-19-15-31-12-10-21(19)27(33)35)24(18-6-8-20(30)9-7-18)23(16)25(17(2)34)36-29(3,4)5;1-16-14-21-27(36-28(31-21)19-8-11-22-23(15-19)34-13-12-33-22)25(18-6-9-20(30)10-7-18)24(16)26(17(2)32)35-29(3,4)5/h7-19,30,33,39H,1-6H3;7-19,32H,1-6H3;6-18,31H,1-5H3,(H,38,41);6-18,30H,1-5H3;6-15,25H,1-5H3;6-11,14-15,26H,12-13H2,1-5H3/t30?,33-;32-;31-;30-;25-;26-/m111111/s1
• InChIKey: ATMUNYFZILJNDM-RSQYEAKMSA-N
• XLogP: 50.41
• TPSA: 451.06 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 41
• Rotatable Bonds: 35
• Heavy Atoms: 247
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3517.84
LogP ≤ 5	50.41
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	41

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one?

The IUPAC name of (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one (CID 157225651) is (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one.

What is the SMILES notation for (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one?

The canonical SMILES for (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one is CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccc4c(c3)OCCO4)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccnc(-c4ccc5cc[nH]c(=O)c5c4)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccnc(-c4ccc5ccn(C)c(=O)c5c4)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3ccnc(-n4ccc5ncccc5c4=O)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-n3ccc4cnccc4c3=O)sc2c1-c1ccc(Cl)cc1.COC1C=Cc2ccc(-c3cc(-c4nc5cc(C)c([C@H](OC(C)(C)C)C(C)=O)c(-c6ccc(Cl)cc6)c5s4)ccn3)cc2N1.

What is the InChIKey of (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one?

The InChIKey is ATMUNYFZILJNDM-RSQYEAKMSA-N. The full InChI is InChI=1S/C36H34ClN3O3S.C36H32ClN3O3S.C35H30ClN3O3S.C34H29ClN4O3S.C29H26ClN3O3S.C29H28ClNO4S/c1-20-17-29-34(32(23-9-12-26(37)13-10-23)31(20)33(21(2)41)43-36(3,4)5)44-35(40-29)25-15-16-38-27(19-25)24-8-7-22-11-14-30(42-6)39-28(22)18-24;1-20-17-29-33(31(23-9-11-26(37)12-10-23)30(20)32(21(2)41)43-36(3,4)5)44-34(39-29)25-13-15-38-28(19-25)24-8-7-22-14-16-40(6)35(42)27(22)18-24;1-19-16-28-32(30(22-8-10-25(36)11-9-22)29(19)31(20(2)40)42-35(3,4)5)43-34(39-28)24-13-14-37-27(18-24)23-7-6-21-12-15-38-33(41)26(21)17-23;1-19-17-26-31(29(21-8-10-23(35)11-9-21)28(19)30(20(2)40)42-34(3,4)5)43-32(38-26)22-12-15-37-27(18-22)39-16-13-25-24(33(39)41)7-6-14-36-25;1-16-14-22-26(37-28(32-22)33-13-11-19-15-31-12-10-21(19)27(33)35)24(18-6-8-20(30)9-7-18)23(16)25(17(2)34)36-29(3,4)5;1-16-14-21-27(36-28(31-21)19-8-11-22-23(15-19)34-13-12-33-22)25(18-6-9-20(30)10-7-18)24(16)26(17(2)32)35-29(3,4)5/h7-19,30,33,39H,1-6H3;7-19,32H,1-6H3;6-18,31H,1-5H3,(H,38,41);6-18,30H,1-5H3;6-15,25H,1-5H3;6-11,14-15,26H,12-13H2,1-5H3/t30?,33-;32-;31-;30-;25-;26-/m111111/s1.

What are the key properties of (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one?

(1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one has a molecular weight of 3517.84 g/mol, XLogP of 50.41, 35 rotatable bonds, 2 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for (1S)-1-[7-(4-chlorophenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-2-[2-(2-methoxy-1,2-dihydroquinolin-7-yl)-4-pyridinyl]-5-methyl-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;2-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2,6-naphthyridin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2H-isoquinolin-1-one;7-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-2-methylisoquinolin-1-one;6-[4-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]-2-pyridinyl]-1,6-naphthyridin-5-one is sourced from PubChem (CID 157225651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).