methyl 4-{[2-(4-carbamoylpiperidin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}benzoate
Chemical Structure Depiction of
methyl 4-{[2-(4-carbamoylpiperidin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}benzoate
methyl 4-{[2-(4-carbamoylpiperidin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}benzoate
Compound characteristics
Compound ID: | 5756-1197 |
Compound Name: | methyl 4-{[2-(4-carbamoylpiperidin-1-yl)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}benzoate |
Molecular Weight: | 373.43 |
Molecular Formula: | C18 H19 N3 O4 S |
Smiles: | COC(c1ccc(\C=C2/C(N=C(N3CCC(CC3)C(N)=O)S2)=O)cc1)=O |
Stereo: | ACHIRAL |
logP: | 1.6678 |
logD: | 1.6678 |
logSw: | -2.1916 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 80.828 |
InChI Key: | AQWHJYHMWOAAIZ-UHFFFAOYSA-N |