(4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone

C16H10FNOS — CID 5133473

IUPAC(4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone
SMILESO=C(c1ccc(F)cc1)c1cnc(-c2ccccc2)s1
InChIInChI=1S/C16H10FNOS/c17-13-8-6-11(7-9-13)15(19)14-10-18-16(20-14)12-4-2-1-3-5-12/h1-10H
InChIKeyCFLDCDBPECMPLB-UHFFFAOYSA-N
MW283.33 g/mol
LogP4.18
Rot. Bonds3

About (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone

(4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone (PubChem CID 5133473) has the molecular formula C16H10FNOS and a molecular weight of 283.33 g/mol. Its IUPAC name is (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone
PubChem CID5133473
Molecular FormulaC16H10FNOS
Molecular Weight283.33 g/mol
Exact Mass283.05
IUPAC Name(4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone
SMILESO=C(c1ccc(F)cc1)c1cnc(-c2ccccc2)s1
InChIInChI=1S/C16H10FNOS/c17-13-8-6-11(7-9-13)15(19)14-10-18-16(20-14)12-4-2-1-3-5-12/h1-10H
InChIKeyCFLDCDBPECMPLB-UHFFFAOYSA-N
XLogP4.18
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,4-Dichlorophenyl)(2-phenyl-1,3-thiazol-5-yl)methanone
CID 1482558
(4-Chlorophenyl)(2-(4-chlorophenyl)-1,3-thiazol-5-yl)methanone
CID 3316145
[2-(4-Chlorophenyl)-1,3-thiazol-5-yl]-phenylmethanone
CID 3789019
(2-(4-Chlorophenyl)-1,3-thiazol-5-yl)(2,4-dichlorophenyl)methanone
CID 3851581
Phenyl(2-phenyl-1,3-thiazol-5-yl)methanone
CID 3780158
2,2,2-Trifluoro-1-(2-phenyl-1,3-thiazol-5-yl)ethanone
CID 17747369
1-(2-Phenyl-1,3-thiazol-5-yl)ethan-1-one
CID 608996
(4-Chlorophenyl)(2-phenyl-1,3-thiazol-5-yl)methanone
CID 2798577
3-Anilino-1-(2-phenyl-1,3-thiazol-5-yl)-2-propen-1-one
CID 5919925
3-(Dimethylamino)-1-(2-phenyl-1,3-thiazol-5-yl)-2-propen-1-one
CID 6184028
3-oxo-3-(2-phenyl-1,3-thiazol-5-yl)propanal O-methyloxime
CID 9638908
2,2,2-Trifluoro-1-(5-(5-phenylthiazol-2-yl)thiophen-2-yl)ethanone
CID 17747368

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone?
The IUPAC name of (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone (CID 5133473) is (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone?
The canonical SMILES for (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone is O=C(c1ccc(F)cc1)c1cnc(-c2ccccc2)s1.
What is the InChIKey of (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone?
The InChIKey is CFLDCDBPECMPLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FNOS/c17-13-8-6-11(7-9-13)15(19)14-10-18-16(20-14)12-4-2-1-3-5-12/h1-10H.
What are the key properties of (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone?
(4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone has a molecular weight of 283.33 g/mol, XLogP of 4.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(2-phenyl-1,3-thiazol-5-yl)methanone is sourced from PubChem (CID 5133473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).