N-{3-(2H-1,3-benzodioxol-5-yl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}phenylalanine
Chemical Structure Depiction of
N-{3-(2H-1,3-benzodioxol-5-yl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}phenylalanine
N-{3-(2H-1,3-benzodioxol-5-yl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}phenylalanine
Compound characteristics
| Compound ID: | 3379-2623 |
| Compound Name: | N-{3-(2H-1,3-benzodioxol-5-yl)-2-[(furan-2-carbonyl)amino]prop-2-enoyl}phenylalanine |
| Molecular Weight: | 448.43 |
| Molecular Formula: | C24 H20 N2 O7 |
| Smiles: | C(C(C(O)=O)NC(/C(=C/c1ccc2c(c1)OCO2)NC(c1ccco1)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8207 |
| logD: | -1.5189 |
| logSw: | -2.1767 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.309 |
| InChI Key: | VELFLYBNDMTWJG-SFHVURJKSA-N |