N-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]tryptophan
Chemical Structure Depiction of
N-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]tryptophan
N-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]tryptophan
Compound characteristics
| Compound ID: | 4710-0023 |
| Compound Name: | N-[2-benzamido-3-(2H-1,3-benzodioxol-5-yl)prop-2-enoyl]tryptophan |
| Molecular Weight: | 497.51 |
| Molecular Formula: | C28 H23 N3 O6 |
| Smiles: | C(C(C(O)=O)NC(/C(=C/c1ccc2c(c1)OCO2)NC(c1ccccc1)=O)=O)c1c[nH]c2ccccc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7351 |
| logD: | -0.6045 |
| logSw: | -3.2439 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 101.601 |
| InChI Key: | KOKYCQPEDYKHNQ-QHCPKHFHSA-N |