1-(benzenesulfonyl)-9H-carbazole-4-carboxamide

C19H14N2O3S — CID 144692825

IUPAC1-(benzenesulfonyl)-9H-carbazole-4-carboxamide
SMILESNC(=O)c1ccc(S(=O)(=O)c2ccccc2)c2[nH]c3ccccc3c12
InChIInChI=1S/C19H14N2O3S/c20-19(22)14-10-11-16(25(23,24)12-6-2-1-3-7-12)18-17(14)13-8-4-5-9-15(13)21-18/h1-11,21H,(H2,20,22)
InChIKeyGPDPERTYIXVBOH-UHFFFAOYSA-N
MW350.40 g/mol
LogP3.25
Rot. Bonds3

About 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide

1-(benzenesulfonyl)-9H-carbazole-4-carboxamide (PubChem CID 144692825) has the molecular formula C19H14N2O3S and a molecular weight of 350.40 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-9H-carbazole-4-carboxamide
PubChem CID144692825
Molecular FormulaC19H14N2O3S
Molecular Weight350.40 g/mol
Exact Mass350.07
IUPAC Name1-(benzenesulfonyl)-9H-carbazole-4-carboxamide
SMILESNC(=O)c1ccc(S(=O)(=O)c2ccccc2)c2[nH]c3ccccc3c12
InChIInChI=1S/C19H14N2O3S/c20-19(22)14-10-11-16(25(23,24)12-6-2-1-3-7-12)18-17(14)13-8-4-5-9-15(13)21-18/h1-11,21H,(H2,20,22)
InChIKeyGPDPERTYIXVBOH-UHFFFAOYSA-N
XLogP3.25
TPSA93.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-(benzenesulfonyl)benzamide
CID 66736112
1-phenyl-9H-carbazole-2-carboxamide
CID 174872973
9H-carbazole-1-carboxamide;hydrochloride
CID 141272518
1,2-bis[2-(benzenesulfonyl)phenyl]-9H-carbazole
CID 174714913
5H-pyridazino[4,5-b]indole-1,4-dicarboxylic acid
CID 91128673
9H-carbazole;carbonic acid
CID 67577328
3,24-diazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1(17),2(10),4,6,8,11,13,15,18,20,22-undecaene
CID 102175677
1-[2-(benzenesulfonyl)-1H-indol-3-yl]-2,2,2-trifluoroethanone
CID 175709241
7,14-dioxo-5,12-dihydroquinolino[2,3-b]acridine-1-carboxamide
CID 139905975
9H-carbazole-3,4-disulfonic acid
CID 87743227
3-(benzenesulfonyl)-1H-quinolin-4-one
CID 6619653
1,2-bis(benzenesulfonyl)benzene
CID 19980733

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide (CID 144692825) is 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide is NC(=O)c1ccc(S(=O)(=O)c2ccccc2)c2[nH]c3ccccc3c12.
What is the InChIKey of 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide?
The InChIKey is GPDPERTYIXVBOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O3S/c20-19(22)14-10-11-16(25(23,24)12-6-2-1-3-7-12)18-17(14)13-8-4-5-9-15(13)21-18/h1-11,21H,(H2,20,22).
What are the key properties of 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide?
1-(benzenesulfonyl)-9H-carbazole-4-carboxamide has a molecular weight of 350.40 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-9H-carbazole-4-carboxamide is sourced from PubChem (CID 144692825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).