N-(2-hydroxyethyl)-N~3~-(9H-purin-6-yl)-beta-alaninamide
Chemical Structure Depiction of
N-(2-hydroxyethyl)-N~3~-(9H-purin-6-yl)-beta-alaninamide
N-(2-hydroxyethyl)-N~3~-(9H-purin-6-yl)-beta-alaninamide
Compound characteristics
| Compound ID: | Y044-0128 |
| Compound Name: | N-(2-hydroxyethyl)-N~3~-(9H-purin-6-yl)-beta-alaninamide |
| Molecular Weight: | 250.26 |
| Molecular Formula: | C10 H14 N6 O2 |
| Smiles: | C(CNc1c2c(ncn1)[nH]cn2)C(NCCO)=O |
| Stereo: | ACHIRAL |
| logP: | -1.5357 |
| logD: | -1.5376 |
| logSw: | -1.4569 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 94.631 |
| InChI Key: | CUMHMQFVNFZPGM-UHFFFAOYSA-N |