N-[2-(1H-indol-3-yl)ethyl]-N~3~-[(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]-beta-alaninamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-N~3~-[(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]-beta-alaninamide
N-[2-(1H-indol-3-yl)ethyl]-N~3~-[(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]-beta-alaninamide
Compound characteristics
| Compound ID: | Y041-5133 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-N~3~-[(2R)-2-(4-oxoquinazolin-3(4H)-yl)propanoyl]-beta-alaninamide |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C24 H25 N5 O3 |
| Smiles: | C[C@H](C(NCCC(NCCc1c[nH]c2ccccc12)=O)=O)N1C=Nc2ccccc2C1=O |
| Stereo: | ABSOLUTE |
| logP: | 0.604 |
| logD: | 0.604 |
| logSw: | -2.273 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.556 |
| InChI Key: | HHXHPOLEBHJKFX-INIZCTEOSA-N |