N-[2-(1H-indol-3-yl)ethyl]-N~3~-(9H-purin-6-yl)-beta-alaninamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-N~3~-(9H-purin-6-yl)-beta-alaninamide
N-[2-(1H-indol-3-yl)ethyl]-N~3~-(9H-purin-6-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | Y044-0130 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-N~3~-(9H-purin-6-yl)-beta-alaninamide |
| Molecular Weight: | 349.39 |
| Molecular Formula: | C18 H19 N7 O |
| Smiles: | C(CNc1c2c(ncn1)[nH]cn2)C(NCCc1c[nH]c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9616 |
| logD: | 0.9597 |
| logSw: | -1.9813 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 87.574 |
| InChI Key: | MXCRKJJZSPXLCF-UHFFFAOYSA-N |