3-{1-[2-(3-chloroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-cyclopentylpropanamide
Chemical Structure Depiction of
3-{1-[2-(3-chloroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-cyclopentylpropanamide
3-{1-[2-(3-chloroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-cyclopentylpropanamide
Compound characteristics
| Compound ID: | C191-0449 |
| Compound Name: | 3-{1-[2-(3-chloroanilino)-2-oxoethyl]-6,7-dimethoxy-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-cyclopentylpropanamide |
| Molecular Weight: | 528.99 |
| Molecular Formula: | C26 H29 Cl N4 O6 |
| Smiles: | COc1cc2C(N(CCC(NC3CCCC3)=O)C(N(CC(Nc3cccc(c3)[Cl])=O)c2cc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9384 |
| logD: | 3.9382 |
| logSw: | -4.3109 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.218 |
| InChI Key: | YYHAOCOAMUTBRG-UHFFFAOYSA-N |