5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole

C23H17N3O2S — CID 132534929

IUPAC5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole
SMILESCc1nc2c3ccccc3n(S(=O)(=O)c3ccccc3)c2nc1-c1ccccc1
InChIInChI=1S/C23H17N3O2S/c1-16-21(17-10-4-2-5-11-17)25-23-22(24-16)19-14-8-9-15-20(19)26(23)29(27,28)18-12-6-3-7-13-18/h2-15H,1H3
InChIKeyFZWOIHKLXQNHAT-UHFFFAOYSA-N
MW399.48 g/mol
LogP4.80
Rot. Bonds3

About 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole

5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole (PubChem CID 132534929) has the molecular formula C23H17N3O2S and a molecular weight of 399.48 g/mol. Its IUPAC name is 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole.

Molecular Properties

Compound Name5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole
PubChem CID132534929
Molecular FormulaC23H17N3O2S
Molecular Weight399.48 g/mol
Exact Mass399.10
IUPAC Name5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole
SMILESCc1nc2c3ccccc3n(S(=O)(=O)c3ccccc3)c2nc1-c1ccccc1
InChIInChI=1S/C23H17N3O2S/c1-16-21(17-10-4-2-5-11-17)25-23-22(24-16)19-14-8-9-15-20(19)26(23)29(27,28)18-12-6-3-7-13-18/h2-15H,1H3
InChIKeyFZWOIHKLXQNHAT-UHFFFAOYSA-N
XLogP4.80
TPSA64.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.48
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(benzenesulfonyl)-3-iodo-2-methylindole
CID 11538519
9-(benzenesulfonyl)-4-methylcarbazole
CID 14594808
3-methyl-1-(4-methylphenyl)-9-(4-methylphenyl)sulfonylpyrido[3,4-b]indole
CID 132547779
1-(benzenesulfonyl)-2-methylbenzimidazole
CID 3468368
1-(benzenesulfonyl)-2-ethenyl-3-methylindole
CID 53243035
1-(benzenesulfonyl)-2-methylindole-3-carbonitrile
CID 139071665
9-(benzenesulfonyl)-N,N,2-trimethylcarbazol-4-amine
CID 70676091
7-(benzenesulfonyl)-4-chloro-6-methyl-2-phenylpyrrolo[2,3-d]pyrimidine
CID 59128311
[1-(benzenesulfonyl)-3-methylindol-2-yl]-phenylmethanone
CID 10452101
4-(benzenesulfonyl)-2-benzyl-1-methyl-3-phenylpyrrolo[3,4-b]indole
CID 15504984
[1-(4-methylphenyl)sulfonyl-3-phenylindol-2-yl]methylphosphane
CID 175023681
7-(benzenesulfonyl)-6-bromo-4-chloro-2-methylpyrrolo[2,3-d]pyrimidine
CID 155686533

Frequently Asked Questions

What is the IUPAC name of 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole?
The IUPAC name of 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole (CID 132534929) is 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole.
What is the SMILES notation for 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole?
The canonical SMILES for 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole is Cc1nc2c3ccccc3n(S(=O)(=O)c3ccccc3)c2nc1-c1ccccc1.
What is the InChIKey of 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole?
The InChIKey is FZWOIHKLXQNHAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3O2S/c1-16-21(17-10-4-2-5-11-17)25-23-22(24-16)19-14-8-9-15-20(19)26(23)29(27,28)18-12-6-3-7-13-18/h2-15H,1H3.
What are the key properties of 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole?
5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole has a molecular weight of 399.48 g/mol, XLogP of 4.80, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzenesulfonyl)-2-methyl-3-phenylpyrazino[2,3-b]indole is sourced from PubChem (CID 132534929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).