N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide

C12H8BrClN4O2S — CID 150603744

IUPACN-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide
SMILESO=S(=O)(Nc1cnc(Br)cn1)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C12H8BrClN4O2S/c13-11-5-17-12(6-16-11)18-21(19,20)10-4-15-9-3-7(14)1-2-8(9)10/h1-6,15H,(H,17,18)
InChIKeyISKZFPAOLWPGIH-UHFFFAOYSA-N
MW387.65 g/mol
LogP3.17
Rot. Bonds3

About N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide

N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide (PubChem CID 150603744) has the molecular formula C12H8BrClN4O2S and a molecular weight of 387.65 g/mol. Its IUPAC name is N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide.

Molecular Properties

Compound NameN-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide
PubChem CID150603744
Molecular FormulaC12H8BrClN4O2S
Molecular Weight387.65 g/mol
Exact Mass385.92
IUPAC NameN-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide
SMILESO=S(=O)(Nc1cnc(Br)cn1)c1c[nH]c2cc(Cl)ccc12
InChIInChI=1S/C12H8BrClN4O2S/c13-11-5-17-12(6-16-11)18-21(19,20)10-4-15-9-3-7(14)1-2-8(9)10/h1-6,15H,(H,17,18)
InChIKeyISKZFPAOLWPGIH-UHFFFAOYSA-N
XLogP3.17
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.65
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide 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

N-(5-bromo-4-methoxypyrimidin-2-yl)-6-chloro-1H-indole-3-sulfonamide
CID 169225707
N-(5-bromopyrazin-2-yl)-4-chloro-2-methoxybenzenesulfonamide
CID 115733519
6-chloro-N-(1,5-dimethylpyrazol-3-yl)-1H-indole-3-sulfonamide
CID 176710724
N-(4-bromo-2,5-difluorophenyl)-6-chloro-1H-indole-3-sulfonamide
CID 135201048
6-chloro-N-[1-(5-fluoro-2-pyridinyl)pyrazol-3-yl]-1H-indole-3-sulfonamide
CID 167894761
6-chloro-N-(4-methylthiophen-3-yl)-1H-indole-3-sulfonamide
CID 176711099
6-chloro-N-(4,5-dimethyl-1H-pyrazol-3-yl)-1H-indole-3-sulfonamide
CID 176710664
6-chloro-N-imidazo[5,1-b][1,3]thiazol-5-yl-1H-indole-3-sulfonamide
CID 176710619
6-chloro-N-(3,3-difluorocyclobutyl)-1H-indole-3-sulfonamide
CID 167817801
N-(5-bromo-4,7-difluoro-3-methylidenecyclohepta-1,4,6-trien-1-yl)-6-chloro-1H-indole-3-sulfonamide
CID 135201451
N-[5-bromo-4-(1,1-difluoroethyl)-6-methoxypyrimidin-2-yl]-6-chloro-1H-indole-3-sulfonamide
CID 164908387
6-chloro-N-(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)-1H-indole-3-sulfonamide
CID 167746508

Frequently Asked Questions

What is the IUPAC name of N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide?
The IUPAC name of N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide (CID 150603744) is N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide.
What is the SMILES notation for N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide?
The canonical SMILES for N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide is O=S(=O)(Nc1cnc(Br)cn1)c1c[nH]c2cc(Cl)ccc12.
What is the InChIKey of N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide?
The InChIKey is ISKZFPAOLWPGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrClN4O2S/c13-11-5-17-12(6-16-11)18-21(19,20)10-4-15-9-3-7(14)1-2-8(9)10/h1-6,15H,(H,17,18).
What are the key properties of N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide?
N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide has a molecular weight of 387.65 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromopyrazin-2-yl)-6-chloro-1H-indole-3-sulfonamide is sourced from PubChem (CID 150603744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).