(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate

C19H15FN2O3S — CID 2367074

IUPAC(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate
SMILESO=C(CNC(=O)c1ccccc1F)OCc1csc(-c2ccccc2)n1
InChIInChI=1S/C19H15FN2O3S/c20-16-9-5-4-8-15(16)18(24)21-10-17(23)25-11-14-12-26-19(22-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,24)
InChIKeyAVQAFMPWGIAIES-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.42
Rot. Bonds6

About (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate

(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate (PubChem CID 2367074) has the molecular formula C19H15FN2O3S and a molecular weight of 370.41 g/mol. Its IUPAC name is (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate.

Molecular Properties

Compound Name(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate
PubChem CID2367074
Molecular FormulaC19H15FN2O3S
Molecular Weight370.41 g/mol
Exact Mass370.08
IUPAC Name(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate
SMILESO=C(CNC(=O)c1ccccc1F)OCc1csc(-c2ccccc2)n1
InChIInChI=1S/C19H15FN2O3S/c20-16-9-5-4-8-15(16)18(24)21-10-17(23)25-11-14-12-26-19(22-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,24)
InChIKeyAVQAFMPWGIAIES-UHFFFAOYSA-N
XLogP3.42
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate?
The IUPAC name of (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate (CID 2367074) is (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate.
What is the SMILES notation for (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate?
The canonical SMILES for (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate is O=C(CNC(=O)c1ccccc1F)OCc1csc(-c2ccccc2)n1.
What is the InChIKey of (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate?
The InChIKey is AVQAFMPWGIAIES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O3S/c20-16-9-5-4-8-15(16)18(24)21-10-17(23)25-11-14-12-26-19(22-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,24).
What are the key properties of (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate?
(2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate has a molecular weight of 370.41 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyl-1,3-thiazol-4-yl)methyl 2-[(2-fluorobenzoyl)amino]acetate is sourced from PubChem (CID 2367074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).