3-amino-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]propanoic acid
Chemical Structure Depiction of
3-amino-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]propanoic acid
3-amino-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]propanoic acid
Compound characteristics
| Compound ID: | R052-2012 |
| Compound Name: | 3-amino-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]propanoic acid |
| Molecular Weight: | 268.27 |
| Molecular Formula: | C12 H16 N2 O5 |
| Smiles: | COc1cc(ccc1OCC(N)=O)C(CC(O)=O)N |
| Stereo: | RACEMIC MIXTURE |
| logP: | -2.5165 |
| logD: | -2.5165 |
| logSw: | -1.4709 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 98.015 |
| InChI Key: | IXNFIEZDVQLKFQ-QMMMGPOBSA-N |