5-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(thiophen-2-yl)methyl]pentanamide
Chemical Structure Depiction of
5-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(thiophen-2-yl)methyl]pentanamide
5-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(thiophen-2-yl)methyl]pentanamide
Compound characteristics
| Compound ID: | C200-6706 |
| Compound Name: | 5-{1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl}-N-[(thiophen-2-yl)methyl]pentanamide |
| Molecular Weight: | 550.63 |
| Molecular Formula: | C28 H30 N4 O6 S |
| Smiles: | COc1ccc(c(c1)NC(CN1C(N(CCCCC(NCc2cccs2)=O)C(c2ccccc12)=O)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8371 |
| logD: | 2.8366 |
| logSw: | -3.6054 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.361 |
| InChI Key: | DEWUMMRCHYGZMM-UHFFFAOYSA-N |