(2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide

C22H17Cl3N2O3S — CID 92670788

About (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide

(2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide (PubChem CID 92670788) has the molecular formula C22H17Cl3N2O3S and a molecular weight of 495.82 g/mol. Its IUPAC name is (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide.

Molecular Properties

• Compound Name: (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide
• PubChem CID: 92670788
• Molecular Formula: C22H17Cl3N2O3S
• Molecular Weight: 495.82 g/mol
• Exact Mass: 494.00
• IUPAC Name: (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide
• SMILES: C[C@@H]1Cc2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)ccc2N1S(=O)(=O)c1ccc(Cl)cc1
• InChI: InChI=1S/C22H17Cl3N2O3S/c1-13-8-15-9-14(22(28)26-19-11-17(24)10-18(25)12-19)2-7-21(15)27(13)31(29,30)20-5-3-16(23)4-6-20/h2-7,9-13H,8H2,1H3,(H,26,28)/t13-/m1/s1
• InChIKey: QJUKJOABSJFXHU-CYBMUJFWSA-N
• XLogP: 6.04
• TPSA: 66.48 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	495.82
LogP ≤ 5	6.04
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide?

The IUPAC name of (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide (CID 92670788) is (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide.

What is the SMILES notation for (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide?

The canonical SMILES for (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide is C[C@@H]1Cc2cc(C(=O)Nc3cc(Cl)cc(Cl)c3)ccc2N1S(=O)(=O)c1ccc(Cl)cc1.

What is the InChIKey of (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide?

The InChIKey is QJUKJOABSJFXHU-CYBMUJFWSA-N. The full InChI is InChI=1S/C22H17Cl3N2O3S/c1-13-8-15-9-14(22(28)26-19-11-17(24)10-18(25)12-19)2-7-21(15)27(13)31(29,30)20-5-3-16(23)4-6-20/h2-7,9-13H,8H2,1H3,(H,26,28)/t13-/m1/s1.

What are the key properties of (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide?

(2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide has a molecular weight of 495.82 g/mol, XLogP of 6.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-1-(4-chlorophenyl)sulfonyl-N-(3,5-dichlorophenyl)-2-methyl-2,3-dihydroindole-5-carboxamide is sourced from PubChem (CID 92670788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).