(4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol

C10H10BrClN2OS — CID 102830320

IUPAC(4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol
SMILESCCn1ccnc1C(O)c1cc(Br)c(Cl)s1
InChIInChI=1S/C10H10BrClN2OS/c1-2-14-4-3-13-10(14)8(15)7-5-6(11)9(12)16-7/h3-5,8,15H,2H2,1H3
InChIKeyCYYVZCVOVXZVRW-UHFFFAOYSA-N
MW321.63 g/mol
LogP3.46
Rot. Bonds3

About (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol

(4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol (PubChem CID 102830320) has the molecular formula C10H10BrClN2OS and a molecular weight of 321.63 g/mol. Its IUPAC name is (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol.

Molecular Properties

Compound Name(4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol
PubChem CID102830320
Molecular FormulaC10H10BrClN2OS
Molecular Weight321.63 g/mol
Exact Mass319.94
IUPAC Name(4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol
SMILESCCn1ccnc1C(O)c1cc(Br)c(Cl)s1
InChIInChI=1S/C10H10BrClN2OS/c1-2-14-4-3-13-10(14)8(15)7-5-6(11)9(12)16-7/h3-5,8,15H,2H2,1H3
InChIKeyCYYVZCVOVXZVRW-UHFFFAOYSA-N
XLogP3.46
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.63
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol 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

(4-bromo-5-methylthiophen-2-yl)-(1-methylimidazol-2-yl)methanol
CID 102829554
(5-chloro-2-fluorophenyl)-(1-ethylimidazol-2-yl)methanol
CID 61314413
(4-bromo-2-methylphenyl)-(1-ethylimidazol-2-yl)methanol
CID 61316871
(2-bromo-5-chlorophenyl)-(1-propylimidazol-2-yl)methanol
CID 66156091
(5-bromo-2-pyridinyl)-(1-ethylimidazol-2-yl)methanol
CID 62960127
(4-bromo-5-chlorothiophen-2-yl)-(5-bromo-3-methyltriazol-4-yl)methanol
CID 106461442
(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-(1-ethylimidazol-2-yl)methanol
CID 63976688
1-(4-bromo-5-chlorothiophen-2-yl)-2-(4-ethylphenyl)ethanol
CID 102829878
1-(1-ethylimidazol-2-yl)-2,2-dimethylbutan-1-ol
CID 115800026
(4-bromo-5-chlorothiophen-2-yl)-pyrimidin-5-ylmethanol
CID 102829986
(3-bromo-5-chlorophenyl)-(1-ethylimidazol-2-yl)methanamine
CID 114019284
(3,5-dimethyl-2-pyridinyl)-(1-ethylimidazol-2-yl)methanol
CID 113365556

Frequently Asked Questions

What is the IUPAC name of (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol?
The IUPAC name of (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol (CID 102830320) is (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol.
What is the SMILES notation for (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol?
The canonical SMILES for (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol is CCn1ccnc1C(O)c1cc(Br)c(Cl)s1.
What is the InChIKey of (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol?
The InChIKey is CYYVZCVOVXZVRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrClN2OS/c1-2-14-4-3-13-10(14)8(15)7-5-6(11)9(12)16-7/h3-5,8,15H,2H2,1H3.
What are the key properties of (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol?
(4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol has a molecular weight of 321.63 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-5-chlorothiophen-2-yl)-(1-ethylimidazol-2-yl)methanol is sourced from PubChem (CID 102830320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).