N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}isoleucine
Chemical Structure Depiction of
N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}isoleucine
N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}isoleucine
Compound characteristics
| Compound ID: | Y042-8667 |
| Compound Name: | N-{[(4-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]acetyl}isoleucine |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C22 H27 N O6 |
| Smiles: | CC[C@@H](C)[C@@H](C(O)=O)NC(COc1ccc2C3CCCCC=3C(=O)Oc2c1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4817 |
| logD: | -1.1054 |
| logSw: | -2.967 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.582 |
| InChI Key: | BFGSOHGJARDVHZ-BLVKFPJESA-N |