N-[(4-methoxyphenyl)methyl]-4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-[(4-methoxyphenyl)methyl]-4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
N-[(4-methoxyphenyl)methyl]-4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061394 |
| Compound Name: | N-[(4-methoxyphenyl)methyl]-4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C25 H23 N3 O3 S |
| Smiles: | COc1ccc(CNC(c2ccc3C(N(CCc4ccccc4)C(Nc3c2)=S)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1574 |
| logD: | 4.1497 |
| logSw: | -4.273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.253 |
| InChI Key: | GNICMSBAMFHQTO-UHFFFAOYSA-N |