9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole

Name: 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₃₄H₂₈N₂O₆S — CID 146530442

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole

SMILESCOc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(S(=O)(=O)n2c3ccc(OC)cc3c3cc(OC)ccc32)cc1

InChIInChI=1S/C34H28N2O6S/c1-39-22-7-13-31-27(17-22)28-18-23(40-2)8-14-32(28)35(31)21-5-11-26(12-6-21)43(37,38)36-33-15-9-24(41-3)19-29(33)30-20-25(42-4)10-16-34(30)36/h5-20H,1-4H3

InChIKeyCACRNEHMVRXNRF-UHFFFAOYSA-N

MW592.67 g/mol

LogP7.16

Rot. Bonds7

About 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole

9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole (PubChem CID 146530442) has the molecular formula C₃₄H₂₈N₂O₆S and a molecular weight of 592.67 g/mol. Its IUPAC name is 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole.

Molecular Properties

Compound Name	9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole
PubChem CID	146530442
Molecular Formula	C₃₄H₂₈N₂O₆S
Molecular Weight	592.67 g/mol
Exact Mass	592.17
IUPAC Name	9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole
SMILES	COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(S(=O)(=O)n2c3ccc(OC)cc3c3cc(OC)ccc32)cc1
InChI	InChI=1S/C34H28N2O6S/c1-39-22-7-13-31-27(17-22)28-18-23(40-2)8-14-32(28)35(31)21-5-11-26(12-6-21)43(37,38)36-33-15-9-24(41-3)19-29(33)30-20-25(42-4)10-16-34(30)36/h5-20H,1-4H3
InChIKey	CACRNEHMVRXNRF-UHFFFAOYSA-N
XLogP	7.16
TPSA	80.92 Å²
H-Bond Donors
H-Bond Acceptors	8
Rotatable Bonds	7
Heavy Atoms	43
Complexity	—

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	592.67
LogP ≤ 5	7.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole?

The IUPAC name of 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole (CID 146530442) is 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole.

What is the SMILES notation for 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole?

The canonical SMILES for 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole is COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc(S(=O)(=O)n2c3ccc(OC)cc3c3cc(OC)ccc32)cc1.

What is the InChIKey of 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole?

The InChIKey is CACRNEHMVRXNRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28N2O6S/c1-39-22-7-13-31-27(17-22)28-18-23(40-2)8-14-32(28)35(31)21-5-11-26(12-6-21)43(37,38)36-33-15-9-24(41-3)19-29(33)30-20-25(42-4)10-16-34(30)36/h5-20H,1-4H3.

What are the key properties of 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole?

9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole has a molecular weight of 592.67 g/mol, XLogP of 7.16, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-(3,6-dimethoxycarbazol-9-yl)sulfonylphenyl]-3,6-dimethoxycarbazole is sourced from PubChem (CID 146530442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 146530442 — identifiers, structure, computed properties (public domain)

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