3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol

C10H12BrN3OS — CID 79946584

IUPAC3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol
SMILESCC(CO)CSc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H12BrN3OS/c1-7(5-15)6-16-10-9-12-2-3-14(9)4-8(11)13-10/h2-4,7,15H,5-6H2,1H3
InChIKeyGQBJQLVTKDQCAI-UHFFFAOYSA-N
MW302.20 g/mol
LogP2.21
Rot. Bonds4

About 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol

3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol (PubChem CID 79946584) has the molecular formula C10H12BrN3OS and a molecular weight of 302.20 g/mol. Its IUPAC name is 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol
PubChem CID79946584
Molecular FormulaC10H12BrN3OS
Molecular Weight302.20 g/mol
Exact Mass300.99
IUPAC Name3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol
SMILESCC(CO)CSc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H12BrN3OS/c1-7(5-15)6-16-10-9-12-2-3-14(9)4-8(11)13-10/h2-4,7,15H,5-6H2,1H3
InChIKeyGQBJQLVTKDQCAI-UHFFFAOYSA-N
XLogP2.21
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.20
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol 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

3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-2-methylpropan-1-ol
CID 79947296
3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-2-methylsulfanylbutan-1-ol
CID 114152179
3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)sulfanylpropane-1,2-diol
CID 80895144
N-ethyl-8-(2-methylpropylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 80893173
6-bromo-8-(oxolan-2-ylmethylsulfanyl)imidazo[1,2-a]pyrazine
CID 106494873
6-bromo-8-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyrazine
CID 79947658
[8-(2-methylpropylsulfanyl)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80924068
6-bromo-8-(4,5,6-trimethylpyrimidin-2-yl)sulfanylimidazo[1,2-a]pyrazine
CID 79946402
8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 107766025
N-ethyl-8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 107765896
6-bromo-N-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyrazin-8-amine
CID 79958961
6-bromo-8-propan-2-yloxyimidazo[1,2-a]pyrazine
CID 79956015

Frequently Asked Questions

What is the IUPAC name of 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol?
The IUPAC name of 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol (CID 79946584) is 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol.
What is the SMILES notation for 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol?
The canonical SMILES for 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol is CC(CO)CSc1nc(Br)cn2ccnc12.
What is the InChIKey of 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol?
The InChIKey is GQBJQLVTKDQCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrN3OS/c1-7(5-15)6-16-10-9-12-2-3-14(9)4-8(11)13-10/h2-4,7,15H,5-6H2,1H3.
What are the key properties of 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol?
3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol has a molecular weight of 302.20 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-bromoimidazo[1,2-a]pyrazin-8-yl)sulfanyl-2-methylpropan-1-ol is sourced from PubChem (CID 79946584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).