4-[(2-chloro-9H-purin-6-yl)amino]butanoic acid
Chemical Structure Depiction of
4-[(2-chloro-9H-purin-6-yl)amino]butanoic acid
4-[(2-chloro-9H-purin-6-yl)amino]butanoic acid
Compound characteristics
| Compound ID: | Y043-0952 |
| Compound Name: | 4-[(2-chloro-9H-purin-6-yl)amino]butanoic acid |
| Molecular Weight: | 255.66 |
| Molecular Formula: | C9 H10 Cl N5 O2 |
| Smiles: | C(CC(O)=O)CNc1c2c(nc(n1)[Cl])[nH]cn2 |
| Stereo: | ACHIRAL |
| logP: | 0.3239 |
| logD: | -2.497 |
| logSw: | -2.2338 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.541 |
| InChI Key: | PYKXZRVCHJACCT-UHFFFAOYSA-N |