ethyl 4-amino-3-(3-chloro-4-fluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-3-(3-chloro-4-fluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
ethyl 4-amino-3-(3-chloro-4-fluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | R052-0864 |
| Compound Name: | ethyl 4-amino-3-(3-chloro-4-fluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 332.8 |
| Molecular Formula: | C12 H10 Cl F N2 O2 S2 |
| Smiles: | CCOC(C1=C(N)N(C(=S)S1)c1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0875 |
| logD: | 3.0875 |
| logSw: | -3.3581 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.868 |
| InChI Key: | MJCFBPBKVBDVIP-UHFFFAOYSA-N |