methyl 4-amino-3-(5-chloro-2-methylphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
methyl 4-amino-3-(5-chloro-2-methylphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
methyl 4-amino-3-(5-chloro-2-methylphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | K286-4355 |
| Compound Name: | methyl 4-amino-3-(5-chloro-2-methylphenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 314.81 |
| Molecular Formula: | C12 H11 Cl N2 O2 S2 |
| Smiles: | Cc1ccc(cc1N1C(=C(C(=O)OC)SC1=S)N)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.2305 |
| logD: | 3.2305 |
| logSw: | -3.4771 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.988 |
| InChI Key: | LOQDUDWGRVXKNP-UHFFFAOYSA-N |