N-[(2,6-dichlorophenyl)methyl]-beta-alanine
Chemical Structure Depiction of
N-[(2,6-dichlorophenyl)methyl]-beta-alanine
N-[(2,6-dichlorophenyl)methyl]-beta-alanine
Compound characteristics
| Compound ID: | K783-1043 |
| Compound Name: | N-[(2,6-dichlorophenyl)methyl]-beta-alanine |
| Molecular Weight: | 248.11 |
| Molecular Formula: | C10 H11 Cl2 N O2 |
| Smiles: | C(CNCc1c(cccc1[Cl])[Cl])C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4723 |
| logD: | 1.4723 |
| logSw: | -2.1539 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.501 |
| InChI Key: | VJHMEJSSMAWDQU-UHFFFAOYSA-N |