ethyl 4-amino-3-(3-nitrophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-3-(3-nitrophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
ethyl 4-amino-3-(3-nitrophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | K286-4381 |
| Compound Name: | ethyl 4-amino-3-(3-nitrophenyl)-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 325.36 |
| Molecular Formula: | C12 H11 N3 O4 S2 |
| Smiles: | CCOC(C1=C(N)N(C(=S)S1)c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3679 |
| logD: | 2.3679 |
| logSw: | -2.6836 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.25 |
| InChI Key: | AEQPBBHFYZDISA-UHFFFAOYSA-N |