1-benzothiophen-2-yl(phenyl)methanone

C15H10OS — CID 3842890

IUPAC1-benzothiophen-2-yl(phenyl)methanone
SMILESO=C(c1ccccc1)c1cc2ccccc2s1
InChIInChI=1S/C15H10OS/c16-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)17-14/h1-10H
InChIKeyKXWSLCVIAOCIQA-UHFFFAOYSA-N
MW238.31 g/mol
LogP4.13
Rot. Bonds2

About 1-benzothiophen-2-yl(phenyl)methanone

1-benzothiophen-2-yl(phenyl)methanone (PubChem CID 3842890) has the molecular formula C15H10OS and a molecular weight of 238.31 g/mol. Its IUPAC name is 1-benzothiophen-2-yl(phenyl)methanone.

Molecular Properties

Compound Name1-benzothiophen-2-yl(phenyl)methanone
PubChem CID3842890
Molecular FormulaC15H10OS
Molecular Weight238.31 g/mol
Exact Mass238.05
IUPAC Name1-benzothiophen-2-yl(phenyl)methanone
SMILESO=C(c1ccccc1)c1cc2ccccc2s1
InChIInChI=1S/C15H10OS/c16-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)17-14/h1-10H
InChIKeyKXWSLCVIAOCIQA-UHFFFAOYSA-N
XLogP4.13
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

bis(1-benzothiophen-2-yl)methanone
CID 5330534
1-benzothiophen-2-yl-(3-hydroxyphenyl)methanone
CID 118714408
[5-(1-benzothiophene-2-carbonyl)thiophen-2-yl]-(1-benzothiophen-2-yl)methanone
CID 58875873
1-benzothiophen-2-yl(furan-3-yl)methanone
CID 71739499
4-(1-benzothiophene-2-carbonyl)-1H-pyrrole-2-carboxylic acid
CID 61406648
benzamide;1-benzothiophene-2-carboxylic acid
CID 158859851
1-benzothiophen-2-yl-(5-methylthiophen-3-yl)methanone
CID 114976116
1-benzothiophen-2-yl(quinolin-6-yl)methanone
CID 115790588
1-benzothiophen-2-yl-(3-ethoxyphenyl)methanone
CID 115791389
1-benzothiophen-2-yl(quinolin-7-yl)methanone
CID 115791003
1-benzothiophen-2-yl-(1-methylpyrazol-4-yl)methanone
CID 114963979
1-benzothiophen-2-yl-(5-chloro-4-methylthiophen-2-yl)methanone
CID 102763000

Frequently Asked Questions

What is the IUPAC name of 1-benzothiophen-2-yl(phenyl)methanone?
The IUPAC name of 1-benzothiophen-2-yl(phenyl)methanone (CID 3842890) is 1-benzothiophen-2-yl(phenyl)methanone.
What is the SMILES notation for 1-benzothiophen-2-yl(phenyl)methanone?
The canonical SMILES for 1-benzothiophen-2-yl(phenyl)methanone is O=C(c1ccccc1)c1cc2ccccc2s1.
What is the InChIKey of 1-benzothiophen-2-yl(phenyl)methanone?
The InChIKey is KXWSLCVIAOCIQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10OS/c16-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)17-14/h1-10H.
What are the key properties of 1-benzothiophen-2-yl(phenyl)methanone?
1-benzothiophen-2-yl(phenyl)methanone has a molecular weight of 238.31 g/mol, XLogP of 4.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzothiophen-2-yl(phenyl)methanone is sourced from PubChem (CID 3842890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).