ethyl 4,5-dimethyl-2-{2-[(4-phenylquinazolin-2-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4,5-dimethyl-2-{2-[(4-phenylquinazolin-2-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 4,5-dimethyl-2-{2-[(4-phenylquinazolin-2-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | D157-0095 |
| Compound Name: | ethyl 4,5-dimethyl-2-{2-[(4-phenylquinazolin-2-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C25 H23 N3 O3 S2 |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(CSc1nc(c2ccccc2)c2ccccc2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6121 |
| logD: | 3.5465 |
| logSw: | -5.7773 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.171 |
| InChI Key: | DFTFBYFKXCIALJ-UHFFFAOYSA-N |