7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride

C12H8ClN3O2S — CID 170742496

IUPAC7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1c[nH]c2c(-c3cnccn3)cccc12
InChIInChI=1S/C12H8ClN3O2S/c13-19(17,18)11-7-16-12-8(2-1-3-9(11)12)10-6-14-4-5-15-10/h1-7,16H
InChIKeyFHHMVFIGKWENSM-UHFFFAOYSA-N
MW293.74 g/mol
LogP2.55
Rot. Bonds2

About 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride

7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride (PubChem CID 170742496) has the molecular formula C12H8ClN3O2S and a molecular weight of 293.74 g/mol. Its IUPAC name is 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride.

Molecular Properties

Compound Name7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride
PubChem CID170742496
Molecular FormulaC12H8ClN3O2S
Molecular Weight293.74 g/mol
Exact Mass293.00
IUPAC Name7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride
SMILESO=S(=O)(Cl)c1c[nH]c2c(-c3cnccn3)cccc12
InChIInChI=1S/C12H8ClN3O2S/c13-19(17,18)11-7-16-12-8(2-1-3-9(11)12)10-6-14-4-5-15-10/h1-7,16H
InChIKeyFHHMVFIGKWENSM-UHFFFAOYSA-N
XLogP2.55
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.74
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(2,2-difluoroethyl)-4,6-dimethoxypyrimidin-2-yl]-7-pyrazin-2-yl-1H-indole-3-sulfonamide
CID 175989421
7-chloro-1H-pyrrolo[2,3-c]pyridine-3-sulfonyl chloride
CID 91619175
1H-pyrrolo[2,3-c]pyridine-3-sulfonyl chloride
CID 83821681
1-oxo-2H-isoquinoline-4-sulfonyl chloride
CID 86598072
6-chloro-7-(3-methyl-2-pyridinyl)-1H-indole-3-sulfonyl chloride
CID 170742564
2-(2-pyridin-2-ylphenyl)pyrazine
CID 91494990
2-(8,9-dihydrochrysen-1-yl)pyrazine
CID 174656645
2-[2-methyl-3-(2-methylphenyl)phenyl]pyrazine
CID 134354488
2-(3-tert-butyl-2-methylphenyl)pyrazine
CID 118462819
5-(1H-indol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 94069309
2-[2-(chloromethyl)phenyl]pyrazine
CID 67883398
3-pyrazin-2-ylfuran-2-sulfonyl fluoride
CID 165451069

Frequently Asked Questions

What is the IUPAC name of 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride?
The IUPAC name of 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride (CID 170742496) is 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride.
What is the SMILES notation for 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride?
The canonical SMILES for 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride is O=S(=O)(Cl)c1c[nH]c2c(-c3cnccn3)cccc12.
What is the InChIKey of 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride?
The InChIKey is FHHMVFIGKWENSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3O2S/c13-19(17,18)11-7-16-12-8(2-1-3-9(11)12)10-6-14-4-5-15-10/h1-7,16H.
What are the key properties of 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride?
7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride has a molecular weight of 293.74 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-pyrazin-2-yl-1H-indole-3-sulfonyl chloride is sourced from PubChem (CID 170742496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).