3-benzyl-6-butyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Chemical Structure Depiction of
3-benzyl-6-butyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
3-benzyl-6-butyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one
Compound characteristics
| Compound ID: | D144-0494 |
| Compound Name: | 3-benzyl-6-butyl-10-methyl-3,4-dihydro-2H,8H-pyrano[3,2-g][1,3]benzoxazin-8-one |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C23 H25 N O3 |
| Smiles: | CCCCC1=CC(=O)Oc2c1cc1CN(Cc3ccccc3)COc1c2C |
| Stereo: | ACHIRAL |
| logP: | 5.3293 |
| logD: | 4.4818 |
| logSw: | -5.2826 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.599 |
| InChI Key: | PEILJJZQPHSRGM-UHFFFAOYSA-N |