(R)-1-benzothiophen-3-yl(phenyl)methanol

C15H12OS — CID 101489601

IUPAC(R)-1-benzothiophen-3-yl(phenyl)methanol
SMILESO[C@H](c1ccccc1)c1csc2ccccc12
InChIInChI=1S/C15H12OS/c16-15(11-6-2-1-3-7-11)13-10-17-14-9-5-4-8-12(13)14/h1-10,15-16H/t15-/m1/s1
InChIKeyZFMHPSIKJYAYFA-OAHLLOKOSA-N
MW240.33 g/mol
LogP3.98
Rot. Bonds2

About (R)-1-benzothiophen-3-yl(phenyl)methanol

(R)-1-benzothiophen-3-yl(phenyl)methanol (PubChem CID 101489601) has the molecular formula C15H12OS and a molecular weight of 240.33 g/mol. Its IUPAC name is (R)-1-benzothiophen-3-yl(phenyl)methanol.

Molecular Properties

Compound Name(R)-1-benzothiophen-3-yl(phenyl)methanol
PubChem CID101489601
Molecular FormulaC15H12OS
Molecular Weight240.33 g/mol
Exact Mass240.06
IUPAC Name(R)-1-benzothiophen-3-yl(phenyl)methanol
SMILESO[C@H](c1ccccc1)c1csc2ccccc12
InChIInChI=1S/C15H12OS/c16-15(11-6-2-1-3-7-11)13-10-17-14-9-5-4-8-12(13)14/h1-10,15-16H/t15-/m1/s1
InChIKeyZFMHPSIKJYAYFA-OAHLLOKOSA-N
XLogP3.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzothiophen-3-yl-(4-methylphenyl)methanol
CID 61088943
1-benzothiophen-3-yl-(4-tert-butylphenyl)methanol
CID 63426745
1-benzothiophen-3-yl(pyridin-3-yl)methanol
CID 61087457
1-benzothiophen-3-yl-(3-bromo-4-methoxyphenyl)methanol
CID 61088025
1-benzothiophen-3-yl-(3-chloro-4-iodophenyl)methanol
CID 103210159
1-benzothiophen-3-yl(2,3-dihydro-1H-inden-5-yl)methanol
CID 61087821
1-benzothiophen-3-yl-(3-bromo-5-fluorophenyl)methanol
CID 61088373
1-benzothiophen-3-yl-(3-chloro-4-methylphenyl)methanol
CID 63194986
(1S)-2-amino-1-(1-benzothiophen-3-yl)ethanol
CID 94550197
1-benzothiophen-3-yl(1H-indol-5-yl)methanol
CID 81437486
(3S)-3-(1-benzothiophen-3-yl)-3-hydroxypropanoic acid
CID 94550405
3-amino-1-(1-benzothiophen-3-yl)-2-methylpropan-1-ol
CID 60733920

Frequently Asked Questions

What is the IUPAC name of (R)-1-benzothiophen-3-yl(phenyl)methanol?
The IUPAC name of (R)-1-benzothiophen-3-yl(phenyl)methanol (CID 101489601) is (R)-1-benzothiophen-3-yl(phenyl)methanol.
What is the SMILES notation for (R)-1-benzothiophen-3-yl(phenyl)methanol?
The canonical SMILES for (R)-1-benzothiophen-3-yl(phenyl)methanol is O[C@H](c1ccccc1)c1csc2ccccc12.
What is the InChIKey of (R)-1-benzothiophen-3-yl(phenyl)methanol?
The InChIKey is ZFMHPSIKJYAYFA-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H12OS/c16-15(11-6-2-1-3-7-11)13-10-17-14-9-5-4-8-12(13)14/h1-10,15-16H/t15-/m1/s1.
What are the key properties of (R)-1-benzothiophen-3-yl(phenyl)methanol?
(R)-1-benzothiophen-3-yl(phenyl)methanol has a molecular weight of 240.33 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-1-benzothiophen-3-yl(phenyl)methanol is sourced from PubChem (CID 101489601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).