7-benzyl-6,10-dimethyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Chemical Structure Depiction of
7-benzyl-6,10-dimethyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
7-benzyl-6,10-dimethyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Compound characteristics
| Compound ID: | D144-0511 |
| Compound Name: | 7-benzyl-6,10-dimethyl-3-[(4-methylphenyl)methyl]-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one |
| Molecular Weight: | 425.53 |
| Molecular Formula: | C28 H27 N O3 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1cc1CN(Cc3ccc(C)cc3)COc1c2C |
| Stereo: | ACHIRAL |
| logP: | 6.306 |
| logD: | 4.9643 |
| logSw: | -5.5527 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.841 |
| InChI Key: | HGJHYTKJOCPUGX-UHFFFAOYSA-N |