(1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide

C197H187Cl5F5N5O19 — CID 157233333

About (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide

(1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide (PubChem CID 157233333) has the molecular formula C197H187Cl5F5N5O19 and a molecular weight of 3200.93 g/mol. Its IUPAC name is (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide.

Molecular Properties

• Compound Name: (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide
• PubChem CID: 157233333
• Molecular Formula: C197H187Cl5F5N5O19
• Molecular Weight: 3200.93 g/mol
• Exact Mass: 3196.22
• IUPAC Name: (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide
• SMILES: CC(=O)[C@@H](OC(C)(C)C)c1c(C)c(F)c2cc(C(N)=O)ccc2c1-c1ccc2c3c(ccnc13)CCO2.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3ccc(F)cc3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3ccccn3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3cccnc3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3ccncc3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(O)(c3ccccc3)C(F)(F)F)cc2c1-c1ccc(Cl)cc1
• InChI: InChI=1S/C34H30ClF3O3.C34H32ClFO3.3C33H32ClNO3.C30H29FN2O4/c1-21-19-25-12-11-23(17-18-33(40,34(36,37)38)26-9-7-6-8-10-26)20-28(25)30(24-13-15-27(35)16-14-24)29(21)31(22(2)39)41-32(3,4)5;1-21-19-25-8-7-23(17-18-34(6,38)26-11-15-28(36)16-12-26)20-29(25)31(24-9-13-27(35)14-10-24)30(21)32(22(2)37)39-33(3,4)5;1-21-19-25-8-7-23(13-16-33(6,37)26-14-17-35-18-15-26)20-28(25)30(24-9-11-27(34)12-10-24)29(21)31(22(2)36)38-32(3,4)5;1-21-18-25-10-9-23(15-16-33(6,37)26-8-7-17-35-20-26)19-28(25)30(24-11-13-27(34)14-12-24)29(21)31(22(2)36)38-32(3,4)5;1-21-19-25-11-10-23(16-17-33(6,37)28-9-7-8-18-35-28)20-27(25)30(24-12-14-26(34)15-13-24)29(21)31(22(2)36)38-32(3,4)5;1-15-23(28(16(2)34)37-30(3,4)5)25(19-7-6-18(29(32)35)14-21(19)26(15)31)20-8-9-22-24-17(11-13-36-22)10-12-33-27(20)24/h6-16,19-20,31,40H,1-5H3;7-16,19-20,32,38H,1-6H3;7-12,14-15,17-20,31,37H,1-6H3;7-14,17-20,31,37H,1-6H3;7-15,18-20,31,37H,1-6H3;6-10,12,14,28H,11,13H2,1-5H3,(H2,32,35)/t31-,33?;32-,34?;3*31-,33?;28-/m111111/s1
• InChIKey: AUIVZQYMTAGNLY-JNXKKEHTSA-N
• XLogP: 45.71
• TPSA: 362.83 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 23
• Rotatable Bonds: 30
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3200.93
LogP ≤ 5	45.71
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide?

The IUPAC name of (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide (CID 157233333) is (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide.

What is the SMILES notation for (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide?

The canonical SMILES for (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide is CC(=O)[C@@H](OC(C)(C)C)c1c(C)c(F)c2cc(C(N)=O)ccc2c1-c1ccc2c3c(ccnc13)CCO2.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3ccc(F)cc3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3ccccn3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3cccnc3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(C)(O)c3ccncc3)cc2c1-c1ccc(Cl)cc1.CC(=O)[C@@H](OC(C)(C)C)c1c(C)cc2ccc(C#CC(O)(c3ccccc3)C(F)(F)F)cc2c1-c1ccc(Cl)cc1.

What is the InChIKey of (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide?

The InChIKey is AUIVZQYMTAGNLY-JNXKKEHTSA-N. The full InChI is InChI=1S/C34H30ClF3O3.C34H32ClFO3.3C33H32ClNO3.C30H29FN2O4/c1-21-19-25-12-11-23(17-18-33(40,34(36,37)38)26-9-7-6-8-10-26)20-28(25)30(24-13-15-27(35)16-14-24)29(21)31(22(2)39)41-32(3,4)5;1-21-19-25-8-7-23(17-18-34(6,38)26-11-15-28(36)16-12-26)20-29(25)31(24-9-13-27(35)14-10-24)30(21)32(22(2)37)39-33(3,4)5;1-21-19-25-8-7-23(13-16-33(6,37)26-14-17-35-18-15-26)20-28(25)30(24-9-11-27(34)12-10-24)29(21)31(22(2)36)38-32(3,4)5;1-21-18-25-10-9-23(15-16-33(6,37)26-8-7-17-35-20-26)19-28(25)30(24-11-13-27(34)14-12-24)29(21)31(22(2)36)38-32(3,4)5;1-21-19-25-11-10-23(16-17-33(6,37)28-9-7-8-18-35-28)20-27(25)30(24-12-14-26(34)15-13-24)29(21)31(22(2)36)38-32(3,4)5;1-15-23(28(16(2)34)37-30(3,4)5)25(19-7-6-18(29(32)35)14-21(19)26(15)31)20-8-9-22-24-17(11-13-36-22)10-12-33-27(20)24/h6-16,19-20,31,40H,1-5H3;7-16,19-20,32,38H,1-6H3;7-12,14-15,17-20,31,37H,1-6H3;7-14,17-20,31,37H,1-6H3;7-15,18-20,31,37H,1-6H3;6-10,12,14,28H,11,13H2,1-5H3,(H2,32,35)/t31-,33?;32-,34?;3*31-,33?;28-/m111111/s1.

What are the key properties of (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide?

(1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide has a molecular weight of 3200.93 g/mol, XLogP of 45.71, 30 rotatable bonds, 6 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for (1S)-1-[1-(4-chlorophenyl)-7-[3-(4-fluorophenyl)-3-hydroxybut-1-ynyl]-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-2-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-3-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-7-(3-hydroxy-3-pyridin-4-ylbut-1-ynyl)-3-methylnaphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;(1S)-1-[1-(4-chlorophenyl)-3-methyl-7-(4,4,4-trifluoro-3-hydroxy-3-phenylbut-1-ynyl)naphthalen-2-yl]-1-[(2-methylpropan-2-yl)oxy]propan-2-one;8-fluoro-7-methyl-6-[(1S)-1-[(2-methylpropan-2-yl)oxy]-2-oxopropyl]-5-(2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaen-10-yl)naphthalene-2-carboxamide is sourced from PubChem (CID 157233333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).