methyl {4-[4-amino-5-(phenylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate
Chemical Structure Depiction of
methyl {4-[4-amino-5-(phenylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate
methyl {4-[4-amino-5-(phenylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate
Compound characteristics
| Compound ID: | F128-0598 |
| Compound Name: | methyl {4-[4-amino-5-(phenylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C19 H17 N3 O3 S2 |
| Smiles: | COC(Cc1ccc(cc1)N1C(=C(C(Nc2ccccc2)=O)SC1=S)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5917 |
| logD: | 2.5916 |
| logSw: | -3.1693 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.785 |
| InChI Key: | VQXOFUQJJKTIQJ-UHFFFAOYSA-N |