methyl 3-[4-amino-5-{[(furan-2-yl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]-4-methylbenzoate
Chemical Structure Depiction of
methyl 3-[4-amino-5-{[(furan-2-yl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]-4-methylbenzoate
methyl 3-[4-amino-5-{[(furan-2-yl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]-4-methylbenzoate
Compound characteristics
| Compound ID: | F128-0568 |
| Compound Name: | methyl 3-[4-amino-5-{[(furan-2-yl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]-4-methylbenzoate |
| Molecular Weight: | 403.48 |
| Molecular Formula: | C18 H17 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1N1C(=C(C(NCc2ccco2)=O)SC1=S)N)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3248 |
| logD: | 3.3248 |
| logSw: | -3.7189 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.15 |
| InChI Key: | YVWQJVUGIUCZKW-UHFFFAOYSA-N |