ethyl 4-[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carbonyl]piperazine-1-carboxylate
ethyl 4-[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | A0060885 |
| Compound Name: | ethyl 4-[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 466.56 |
| Molecular Formula: | C24 H26 N4 O4 S |
| Smiles: | CCOC(N1CCN(CC1)C(c1ccc2C(N(CCc3ccccc3)C(Nc2c1)=S)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0439 |
| logD: | 3.0424 |
| logSw: | -3.5164 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.725 |
| InChI Key: | UEVUWVKMJSLEJT-UHFFFAOYSA-N |