N-({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetyl)norvaline
Chemical Structure Depiction of
N-({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetyl)norvaline
N-({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetyl)norvaline
Compound characteristics
| Compound ID: | Y041-4653 |
| Compound Name: | N-({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetyl)norvaline |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C26 H27 N O8 |
| Smiles: | CCCC(C(O)=O)NC(COc1ccc2C(C(=C(C)Oc2c1)c1ccc2c(c1)OCCCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0621 |
| logD: | -1.5558 |
| logSw: | -2.881 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.489 |
| InChI Key: | HPFIUDPESZTLBT-IBGZPJMESA-N |