(2,5-dichlorothiophen-3-yl)-phenylmethanol

C11H8Cl2OS — CID 61082614

IUPAC(2,5-dichlorothiophen-3-yl)-phenylmethanol
SMILESOC(c1ccccc1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H8Cl2OS/c12-9-6-8(11(13)15-9)10(14)7-4-2-1-3-5-7/h1-6,10,14H
InChIKeyVDGPKARVGNIIMG-UHFFFAOYSA-N
MW259.16 g/mol
LogP4.14
Rot. Bonds2

About (2,5-dichlorothiophen-3-yl)-phenylmethanol

(2,5-dichlorothiophen-3-yl)-phenylmethanol (PubChem CID 61082614) has the molecular formula C11H8Cl2OS and a molecular weight of 259.16 g/mol. Its IUPAC name is (2,5-dichlorothiophen-3-yl)-phenylmethanol.

Molecular Properties

Compound Name(2,5-dichlorothiophen-3-yl)-phenylmethanol
PubChem CID61082614
Molecular FormulaC11H8Cl2OS
Molecular Weight259.16 g/mol
Exact Mass257.97
IUPAC Name(2,5-dichlorothiophen-3-yl)-phenylmethanol
SMILESOC(c1ccccc1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H8Cl2OS/c12-9-6-8(11(13)15-9)10(14)7-4-2-1-3-5-7/h1-6,10,14H
InChIKeyVDGPKARVGNIIMG-UHFFFAOYSA-N
XLogP4.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.16
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2,5-dichlorothiophen-3-yl)-phenylmethanol 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-bromophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 61082620
(2,5-dichlorothiophen-3-yl)-(2-fluorophenyl)methanol
CID 61082413
2-[(2,5-dichlorothiophen-3-yl)-hydroxymethyl]benzoic acid
CID 43167368
(2,5-dichlorothiophen-3-yl)-(furan-3-yl)methanol
CID 61081034
(2,5-dichlorothiophen-3-yl)-(3-propan-2-yloxyphenyl)methanol
CID 62919997
(2,5-dichlorothiophen-3-yl)-[3-(trifluoromethoxy)phenyl]methanol
CID 107969653
(2,5-dichlorothiophen-3-yl)-(4-fluoro-3-methoxyphenyl)methanol
CID 81284207
(2,4-dichlorophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 63426938
(3-bromo-5-fluorophenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 61080476
(2-chloro-4-methylphenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 106862706
(R)-[2-[(S)-hydroxy(phenyl)methyl]phenyl]-phenylmethanol
CID 92542463
(2-chloro-4,5-dimethylphenyl)-(2,5-dichlorothiophen-3-yl)methanol
CID 107964349

Frequently Asked Questions

What is the IUPAC name of (2,5-dichlorothiophen-3-yl)-phenylmethanol?
The IUPAC name of (2,5-dichlorothiophen-3-yl)-phenylmethanol (CID 61082614) is (2,5-dichlorothiophen-3-yl)-phenylmethanol.
What is the SMILES notation for (2,5-dichlorothiophen-3-yl)-phenylmethanol?
The canonical SMILES for (2,5-dichlorothiophen-3-yl)-phenylmethanol is OC(c1ccccc1)c1cc(Cl)sc1Cl.
What is the InChIKey of (2,5-dichlorothiophen-3-yl)-phenylmethanol?
The InChIKey is VDGPKARVGNIIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl2OS/c12-9-6-8(11(13)15-9)10(14)7-4-2-1-3-5-7/h1-6,10,14H.
What are the key properties of (2,5-dichlorothiophen-3-yl)-phenylmethanol?
(2,5-dichlorothiophen-3-yl)-phenylmethanol has a molecular weight of 259.16 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dichlorothiophen-3-yl)-phenylmethanol is sourced from PubChem (CID 61082614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).