N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}-beta-alanyl-L-methionine
Chemical Structure Depiction of
N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}-beta-alanyl-L-methionine
N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}-beta-alanyl-L-methionine
Compound characteristics
| Compound ID: | Y040-8495 |
| Compound Name: | N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}-beta-alanyl-L-methionine |
| Molecular Weight: | 490.57 |
| Molecular Formula: | C24 H30 N2 O7 S |
| Smiles: | Cc1c(ccc2C3CCCCC=3C(=O)Oc12)OCC(NCCC(N[C@@H](CCSC)C(O)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.3097 |
| logD: | -2.3082 |
| logSw: | -2.2618 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.174 |
| InChI Key: | MAVSPDJVRUUPGP-SFHVURJKSA-N |