methyl {4-[4-amino-5-(cyclohexylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate
Chemical Structure Depiction of
methyl {4-[4-amino-5-(cyclohexylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate
methyl {4-[4-amino-5-(cyclohexylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate
Compound characteristics
| Compound ID: | F128-0599 |
| Compound Name: | methyl {4-[4-amino-5-(cyclohexylcarbamoyl)-2-sulfanylidene-1,3-thiazol-3(2H)-yl]phenyl}acetate |
| Molecular Weight: | 405.54 |
| Molecular Formula: | C19 H23 N3 O3 S2 |
| Smiles: | COC(Cc1ccc(cc1)N1C(=C(C(NC2CCCCC2)=O)SC1=S)N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8937 |
| logD: | 2.8937 |
| logSw: | -3.3291 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 67.832 |
| InChI Key: | IKSHGKNUUAWATO-UHFFFAOYSA-N |