6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide

C93H92Cl2FN9O10S5 — CID 158423776

About 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide

6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide (PubChem CID 158423776) has the molecular formula C93H92Cl2FN9O10S5 and a molecular weight of 1746.05 g/mol. Its IUPAC name is 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide.

Molecular Properties

• Compound Name: 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide
• PubChem CID: 158423776
• Molecular Formula: C93H92Cl2FN9O10S5
• Molecular Weight: 1746.05 g/mol
• Exact Mass: 1743.49
• IUPAC Name: 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide
• SMILES: CN1CCc2[nH]c3ccc(S(=O)(=O)Nc4cccc(Cl)c4)cc3c2C1.CN1CCc2[nH]c3ccc(S(=O)(=O)Nc4ccccc4)cc3c2C1.Cn1c2c(c3cc(S(=O)(=O)c4cccc(Cl)c4)ccc31)CCCC2.Cn1c2c(c3cc(S(=O)(=O)c4cccc(F)c4)ccc31)CCCC2.Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)ccc31)CCCC2
• InChI: InChI=1S/C19H18ClNO2S.C19H18FNO2S.C19H19NO2S.C18H18ClN3O2S.C18H19N3O2S/c2*1-21-18-8-3-2-7-16(18)17-12-15(9-10-19(17)21)24(22,23)14-6-4-5-13(20)11-14;1-20-18-10-6-5-9-16(18)17-13-15(11-12-19(17)20)23(21,22)14-7-3-2-4-8-14;1-22-8-7-18-16(11-22)15-10-14(5-6-17(15)20-18)25(23,24)21-13-4-2-3-12(19)9-13;1-21-10-9-18-16(12-21)15-11-14(7-8-17(15)19-18)24(22,23)20-13-5-3-2-4-6-13/h2*4-6,9-12H,2-3,7-8H2,1H3;2-4,7-8,11-13H,5-6,9-10H2,1H3;2-6,9-10,20-21H,7-8,11H2,1H3;2-8,11,19-20H,9-10,12H2,1H3
• InChIKey: HAUMZMMZRAOVIK-UHFFFAOYSA-N
• XLogP: 19.03
• TPSA: 247.61 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 15
• Rotatable Bonds: 12
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1746.05
LogP ≤ 5	19.03
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide?

The IUPAC name of 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide (CID 158423776) is 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide.

What is the SMILES notation for 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide?

The canonical SMILES for 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide is CN1CCc2[nH]c3ccc(S(=O)(=O)Nc4cccc(Cl)c4)cc3c2C1.CN1CCc2[nH]c3ccc(S(=O)(=O)Nc4ccccc4)cc3c2C1.Cn1c2c(c3cc(S(=O)(=O)c4cccc(Cl)c4)ccc31)CCCC2.Cn1c2c(c3cc(S(=O)(=O)c4cccc(F)c4)ccc31)CCCC2.Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)ccc31)CCCC2.

What is the InChIKey of 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide?

The InChIKey is HAUMZMMZRAOVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClNO2S.C19H18FNO2S.C19H19NO2S.C18H18ClN3O2S.C18H19N3O2S/c2*1-21-18-8-3-2-7-16(18)17-12-15(9-10-19(17)21)24(22,23)14-6-4-5-13(20)11-14;1-20-18-10-6-5-9-16(18)17-13-15(11-12-19(17)20)23(21,22)14-7-3-2-4-8-14;1-22-8-7-18-16(11-22)15-10-14(5-6-17(15)20-18)25(23,24)21-13-4-2-3-12(19)9-13;1-21-10-9-18-16(12-21)15-11-14(7-8-17(15)19-18)24(22,23)20-13-5-3-2-4-6-13/h2*4-6,9-12H,2-3,7-8H2,1H3;2-4,7-8,11-13H,5-6,9-10H2,1H3;2-6,9-10,20-21H,7-8,11H2,1H3;2-8,11,19-20H,9-10,12H2,1H3.

What are the key properties of 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide?

6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide has a molecular weight of 1746.05 g/mol, XLogP of 19.03, 12 rotatable bonds, 4 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(benzenesulfonyl)-9-methyl-1,2,3,4-tetrahydrocarbazole;N-(3-chlorophenyl)-2-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide;6-(3-chlorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;6-(3-fluorophenyl)sulfonyl-9-methyl-1,2,3,4-tetrahydrocarbazole;2-methyl-N-phenyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-sulfonamide is sourced from PubChem (CID 158423776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).