N-(3-chloro-2-methylphenyl)-N~2~-(prop-2-en-1-yl)asparagine
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-N~2~-(prop-2-en-1-yl)asparagine
N-(3-chloro-2-methylphenyl)-N~2~-(prop-2-en-1-yl)asparagine
Compound characteristics
| Compound ID: | 4553-3704 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-N~2~-(prop-2-en-1-yl)asparagine |
| Molecular Weight: | 296.75 |
| Molecular Formula: | C14 H17 Cl N2 O3 |
| Smiles: | [H]N(CC=C)C(CC(N([H])c1cccc(c1C)[Cl])=O)C(=O)O[H] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.845 |
| logD: | -2.1483 |
| logSw: | -2.1656 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 62.398 |
| InChI Key: | QNKRLFTYMZRJJC-LBPRGKRZSA-N |