7-methyl-10-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one
Chemical Structure Depiction of
7-methyl-10-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one
7-methyl-10-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one
Compound characteristics
| Compound ID: | D144-0489 |
| Compound Name: | 7-methyl-10-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4,10,11-hexahydro-5H,9H-[2]benzopyrano[4,3-g][1,3]benzoxazin-5-one |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C26 H29 N O6 |
| Smiles: | Cc1c2c(CN(Cc3cc(c(c(c3)OC)OC)OC)CO2)cc2C3CCCCC=3C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 4.7252 |
| logD: | 1.3115 |
| logSw: | -4.4976 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.012 |
| InChI Key: | BHBPJEABNSWTNZ-UHFFFAOYSA-N |