N-[4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]-beta-alanine
Chemical Structure Depiction of
N-[4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]-beta-alanine
N-[4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]-beta-alanine
Compound characteristics
| Compound ID: | Y042-2769 |
| Compound Name: | N-[4-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)butanoyl]-beta-alanine |
| Molecular Weight: | 319.31 |
| Molecular Formula: | C15 H17 N3 O5 |
| Smiles: | C(CC(NCCC(O)=O)=O)CN1C(c2ccccc2NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.7155 |
| logD: | -3.4111 |
| logSw: | -2.1005 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.427 |
| InChI Key: | GBZORYXUEJLYKC-UHFFFAOYSA-N |