ethyl 4-[4-amino-5-{[(4-methylphenyl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[4-amino-5-{[(4-methylphenyl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate
ethyl 4-[4-amino-5-{[(4-methylphenyl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate
Compound characteristics
| Compound ID: | F128-0213 |
| Compound Name: | ethyl 4-[4-amino-5-{[(4-methylphenyl)methyl]carbamoyl}-2-sulfanylidene-1,3-thiazol-3(2H)-yl]benzoate |
| Molecular Weight: | 427.54 |
| Molecular Formula: | C21 H21 N3 O3 S2 |
| Smiles: | CCOC(c1ccc(cc1)N1C(=C(C(NCc2ccc(C)cc2)=O)SC1=S)N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9568 |
| logD: | 3.9568 |
| logSw: | -4.0992 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 68.282 |
| InChI Key: | HFQOOCNIDNOOFQ-UHFFFAOYSA-N |