Ethyl 4-(1,3-thiazol-2-ylcarbamoylamino)benzoate

HCID 307683

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 69123-45-1
Standard SMILES: CCOC(=O)c1ccc(NC(=O)Nc2nccs2)cc1
InChIKey: OMEMETVMVIWGLI-UHFFFAOYSA-N
Molecular formula: C13H13N3O3S
Average molar mass: 291.33 g/mol
Monoisotopic mass: 291.06776246

Names & identifiers

Preferred name: Ethyl 4-(1,3-thiazol-2-ylcarbamoylamino)benzoate
IUPAC: ethyl 4-(1,3-thiazol-2-ylcarbamoylamino)benzoate

Names & synonyms

69123-45-1ethyl 4-(1,3-thiazol-2-ylcarbamoylamino)benzoateNSC205795CHEMBL3230515SCHEMBL31238157DTXSID80308632NSC-205795ETHYL 4-{[(1,3-THIAZOL-2-YL)CARBAMOYL]AMINO}BENZOATE

Database identifiers

CAS: 69123-45-1
PubChem CID: 307683
DTXSID: DTXSID80308632
ChEMBL: CHEMBL3230515

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 109 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 5
Heavy atoms: 20
Formal charge: 0
Complexity: 346

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…