[4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone

C14H9NO2S — CID 55201038

IUPAC[4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone
SMILESO=C(c1ccccc1)c1nc(-c2ccco2)cs1
InChIInChI=1S/C14H9NO2S/c16-13(10-5-2-1-3-6-10)14-15-11(9-18-14)12-7-4-8-17-12/h1-9H
InChIKeyVRLXRWOEBWMJGJ-UHFFFAOYSA-N
MW255.30 g/mol
LogP3.63
Rot. Bonds3

About [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone

[4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone (PubChem CID 55201038) has the molecular formula C14H9NO2S and a molecular weight of 255.30 g/mol. Its IUPAC name is [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone.

Molecular Properties

Compound Name[4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone
PubChem CID55201038
Molecular FormulaC14H9NO2S
Molecular Weight255.30 g/mol
Exact Mass255.04
IUPAC Name[4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone
SMILESO=C(c1ccccc1)c1nc(-c2ccco2)cs1
InChIInChI=1S/C14H9NO2S/c16-13(10-5-2-1-3-6-10)14-15-11(9-18-14)12-7-4-8-17-12/h1-9H
InChIKeyVRLXRWOEBWMJGJ-UHFFFAOYSA-N
XLogP3.63
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(2-fluorophenyl)-1,3-thiazol-2-yl]-phenylmethanone
CID 63102619
[4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-yl]-phenylmethanone
CID 55201232
[4-(2,5-dimethylphenyl)-1,3-thiazol-2-yl]-phenylmethanone
CID 63524212
[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]-phenylmethanone
CID 63102442
[4-(furan-2-yl)phenyl]-phenylmethanone
CID 14657656
[4-(furan-2-yl)-2-(methylamino)-1,3-thiazol-5-yl]-phenylmethanone
CID 44581364
(E)-3-(2-chlorophenyl)-2-[4-(furan-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
CID 18864266
[4-(1-ethylpyrazol-4-yl)-1,3-thiazol-2-yl]-phenylmethanone
CID 63346809
2-[4-(furan-2-yl)-1,3-thiazol-2-yl]guanidine
CID 13387169
methyl 3-[[4-(furan-2-yl)-1,3-thiazol-2-yl]amino]benzoate
CID 84566051
6-(furan-2-yl)pyridine-2-carboxylic acid
CID 24730128
4-(furan-2-yl)pyrimidine-2-carboxylic acid
CID 82404248

Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
The IUPAC name of [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone (CID 55201038) is [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone.
What is the SMILES notation for [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
The canonical SMILES for [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone is O=C(c1ccccc1)c1nc(-c2ccco2)cs1.
What is the InChIKey of [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
The InChIKey is VRLXRWOEBWMJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9NO2S/c16-13(10-5-2-1-3-6-10)14-15-11(9-18-14)12-7-4-8-17-12/h1-9H.
What are the key properties of [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone?
[4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone has a molecular weight of 255.30 g/mol, XLogP of 3.63, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-yl)-1,3-thiazol-2-yl]-phenylmethanone is sourced from PubChem (CID 55201038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).