3-(2,4-dimethoxyphenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Chemical Structure Depiction of
3-(2,4-dimethoxyphenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
3-(2,4-dimethoxyphenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | A0061531 |
| Compound Name: | 3-(2,4-dimethoxyphenyl)-4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazoline-7-carboxamide |
| Molecular Weight: | 482.56 |
| Molecular Formula: | C24 H26 N4 O5 S |
| Smiles: | COc1ccc(c(c1)OC)N1C(c2ccc(cc2NC1=S)C(NCCCN1CCCC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3935 |
| logD: | 1.3901 |
| logSw: | -2.5381 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.347 |
| InChI Key: | TZTMSPHKDUVANX-UHFFFAOYSA-N |