(2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one

C190H204Cl6N26O14S6 — CID 159256245

About (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one

(2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one (PubChem CID 159256245) has the molecular formula C190H204Cl6N26O14S6 and a molecular weight of 3481.01 g/mol. Its IUPAC name is (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one.

Molecular Properties

• Compound Name: (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one
• PubChem CID: 159256245
• Molecular Formula: C190H204Cl6N26O14S6
• Molecular Weight: 3481.01 g/mol
• Exact Mass: 3475.25
• IUPAC Name: (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one
• SMILES: CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3cccc(-c4cnc(=O)n(C)c4)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3cncc(N4CCN(C)CC4)n3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3nccc(N4CCN(C)CC4)n3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(N3CCN(C(C)C)C(c4ccc5c(cnn5C)c4)C3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(N3CCN(C)C(c4ccc5c(cnn5C)c4)C3)sc2c1-c1ccc(Cl)cc1.Cc1cc2nc(-c3ccc4ncn(C)c4c3)sc2c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(=O)O
• InChI: InChI=1S/C36H42ClN5O2S.C34H38ClN5O2S.C32H30ClN3O3S.2C30H34ClN5O2S.C28H26ClN3O3S/c1-21(2)42-16-15-41(20-30(42)25-11-14-29-26(18-25)19-38-40(29)8)35-39-28-17-22(3)31(33(23(4)43)44-36(5,6)7)32(34(28)45-35)24-9-12-27(37)13-10-24;1-20-16-26-32(30(22-8-11-25(35)12-9-22)29(20)31(21(2)41)42-34(3,4)5)43-33(37-26)40-15-14-38(6)28(19-40)23-10-13-27-24(17-23)18-36-39(27)7;1-18-14-25-29(27(20-10-12-24(33)13-11-20)26(18)28(19(2)37)39-32(3,4)5)40-30(35-25)22-9-7-8-21(15-22)23-16-34-31(38)36(6)17-23;1-18-15-22-28(39-29(34-22)23-16-32-17-24(33-23)36-13-11-35(6)12-14-36)26(20-7-9-21(31)10-8-20)25(18)27(19(2)37)38-30(3,4)5;1-18-17-22-27(39-29(33-22)28-32-12-11-23(34-28)36-15-13-35(6)14-16-36)25(20-7-9-21(31)10-8-20)24(18)26(19(2)37)38-30(3,4)5;1-15-12-20-25(36-26(31-20)17-8-11-19-21(13-17)32(5)14-30-19)23(16-6-9-18(29)10-7-16)22(15)24(27(33)34)35-28(2,3)4/h9-14,17-19,21,30,33H,15-16,20H2,1-8H3;8-13,16-18,28,31H,14-15,19H2,1-7H3;7-17,28H,1-6H3;7-10,15-17,27H,11-14H2,1-6H3;7-12,17,26H,13-16H2,1-6H3;6-14,24H,1-5H3,(H,33,34)/t30?,33-;28?,31-;28-;27-;26-;24-/m111110/s1
• InChIKey: KVXXRFXEWMOVNH-GAFDTARYSA-N
• XLogP: 44.65
• TPSA: 421.20 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 45
• Rotatable Bonds: 36
• Heavy Atoms: 242
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3481.01
LogP ≤ 5	44.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	45

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one?

The IUPAC name of (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one (CID 159256245) is (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one.

What is the SMILES notation for (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one?

The canonical SMILES for (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one is CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3cccc(-c4cnc(=O)n(C)c4)c3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3cncc(N4CCN(C)CC4)n3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(-c3nccc(N4CCN(C)CC4)n3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(N3CCN(C(C)C)C(c4ccc5c(cnn5C)c4)C3)sc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2nc(N3CCN(C)C(c4ccc5c(cnn5C)c4)C3)sc2c1-c1ccc(Cl)cc1.Cc1cc2nc(-c3ccc4ncn(C)c4c3)sc2c(-c2ccc(Cl)cc2)c1[C@H](OC(C)(C)C)C(=O)O.

What is the InChIKey of (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one?

The InChIKey is KVXXRFXEWMOVNH-GAFDTARYSA-N. The full InChI is InChI=1S/C36H42ClN5O2S.C34H38ClN5O2S.C32H30ClN3O3S.2C30H34ClN5O2S.C28H26ClN3O3S/c1-21(2)42-16-15-41(20-30(42)25-11-14-29-26(18-25)19-38-40(29)8)35-39-28-17-22(3)31(33(23(4)43)44-36(5,6)7)32(34(28)45-35)24-9-12-27(37)13-10-24;1-20-16-26-32(30(22-8-11-25(35)12-9-22)29(20)31(21(2)41)42-34(3,4)5)43-33(37-26)40-15-14-38(6)28(19-40)23-10-13-27-24(17-23)18-36-39(27)7;1-18-14-25-29(27(20-10-12-24(33)13-11-20)26(18)28(19(2)37)39-32(3,4)5)40-30(35-25)22-9-7-8-21(15-22)23-16-34-31(38)36(6)17-23;1-18-15-22-28(39-29(34-22)23-16-32-17-24(33-23)36-13-11-35(6)12-14-36)26(20-7-9-21(31)10-8-20)25(18)27(19(2)37)38-30(3,4)5;1-18-17-22-27(39-29(33-22)28-32-12-11-23(34-28)36-15-13-35(6)14-16-36)25(20-7-9-21(31)10-8-20)24(18)26(19(2)37)38-30(3,4)5;1-15-12-20-25(36-26(31-20)17-8-11-19-21(13-17)32(5)14-30-19)23(16-6-9-18(29)10-7-16)22(15)24(27(33)34)35-28(2,3)4/h9-14,17-19,21,30,33H,15-16,20H2,1-8H3;8-13,16-18,28,31H,14-15,19H2,1-7H3;7-17,28H,1-6H3;7-10,15-17,27H,11-14H2,1-6H3;7-12,17,26H,13-16H2,1-6H3;6-14,24H,1-5H3,(H,33,34)/t30?,33-;28?,31-;28-;27-;26-;24-/m111110/s1.

What are the key properties of (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one?

(2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one has a molecular weight of 3481.01 g/mol, XLogP of 44.65, 36 rotatable bonds, 1 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-2-[7-(4-chlorophenyl)-5-methyl-2-(3-methylbenzimidazol-5-yl)-1,3-benzothiazol-6-yl]-2-[(2-methylpropan-2-yl)oxy]acetic acid;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[3-(1-methylindazol-5-yl)-4-propan-2-ylpiperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-methyl-3-(1-methylindazol-5-yl)piperazin-1-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[6-(4-methylpiperazin-1-yl)pyrazin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[7-(4-chlorophenyl)-5-methyl-2-[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]-1,3-benzothiazol-6-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;5-[3-[7-(4-chlorophenyl)-5-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-1,3-benzothiazol-2-yl]phenyl]-1-methylpyrimidin-2-one is sourced from PubChem (CID 159256245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).