methyl 4-amino-3-(3,4-difluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
methyl 4-amino-3-(3,4-difluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
methyl 4-amino-3-(3,4-difluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | K286-4393 |
| Compound Name: | methyl 4-amino-3-(3,4-difluorophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 302.32 |
| Molecular Formula: | C11 H8 F2 N2 O2 S2 |
| Smiles: | COC(C1=C(N)N(C(=S)S1)c1ccc(c(c1)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4386 |
| logD: | 2.4386 |
| logSw: | -2.7363 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.289 |
| InChI Key: | HGEHMQDRYPCZEM-UHFFFAOYSA-N |