methyl 2-(5-{[2-(2-chloroanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
methyl 2-(5-{[2-(2-chloroanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}furan-2-yl)benzoate
methyl 2-(5-{[2-(2-chloroanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}furan-2-yl)benzoate
Compound characteristics
Compound ID: | 4611-0030 |
Compound Name: | methyl 2-(5-{[2-(2-chloroanilino)-4-oxo-1,3-thiazol-5(4H)-ylidene]methyl}furan-2-yl)benzoate |
Molecular Weight: | 438.89 |
Molecular Formula: | C22 H15 Cl N2 O4 S |
Smiles: | COC(c1ccccc1c1ccc(\C=C2/C(N=C(Nc3ccccc3[Cl])S2)=O)o1)=O |
Stereo: | ACHIRAL |
logP: | 4.8975 |
logD: | 4.8869 |
logSw: | -4.9096 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.67 |
InChI Key: | YFUKDNFDIIYZKM-UHFFFAOYSA-N |