benzyl 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
benzyl 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
benzyl 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | 4075-3535 |
| Compound Name: | benzyl 3-(4-chlorophenyl)-4-methyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 375.89 |
| Molecular Formula: | C18 H14 Cl N O2 S2 |
| Smiles: | CC1=C(C(=O)OCc2ccccc2)SC(N1c1ccc(cc1)[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 4.89 |
| logD: | 4.89 |
| logSw: | -5.0486 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 23.4052 |
| InChI Key: | SEMWOTOQTIRSGT-UHFFFAOYSA-N |