ethyl 4-[4-amino-5-(pyrrolidine-1-carbonyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[4-amino-5-(pyrrolidine-1-carbonyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate
ethyl 4-[4-amino-5-(pyrrolidine-1-carbonyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate
Compound characteristics
| Compound ID: | K286-0110 |
| Compound Name: | ethyl 4-[4-amino-5-(pyrrolidine-1-carbonyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate |
| Molecular Weight: | 377.48 |
| Molecular Formula: | C17 H19 N3 O3 S2 |
| Smiles: | CCOC(c1ccc(cc1)N1C(=C(C(N2CCCC2)=O)SC1=S)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8329 |
| logD: | 2.8329 |
| logSw: | -3.0758 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.883 |
| InChI Key: | HWMTZGMJIDACFH-UHFFFAOYSA-N |