N-[2-(1H-indol-3-yl)ethyl]-N~2~-[rel-(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]alaninamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-N~2~-[rel-(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]alaninamide
N-[2-(1H-indol-3-yl)ethyl]-N~2~-[rel-(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]alaninamide
Compound characteristics
| Compound ID: | D715-2848 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-N~2~-[rel-(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]alaninamide |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C24 H25 N5 O3 |
| Smiles: | C[C@@H](C(NCCc1c[nH]c2ccccc12)=O)NC([C@@H](C)N1C=Nc2ccccc2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.2389 |
| logD: | 1.2389 |
| logSw: | -2.2184 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.091 |
| InChI Key: | WKBONKNLKZTFQC-CVEARBPZSA-N |