3-[(3,4,5-trimethoxyphenyl)methyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-[(3,4,5-trimethoxyphenyl)methyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-[(3,4,5-trimethoxyphenyl)methyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | Y040-3816 |
| Compound Name: | 3-[(3,4,5-trimethoxyphenyl)methyl]-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C25 H27 N O6 |
| Smiles: | COc1cc(CN2Cc3c(ccc4C5CCCCC=5C(=O)Oc34)OC2)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.2612 |
| logD: | 1.9364 |
| logSw: | -4.3745 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.327 |
| InChI Key: | IWNCZUJXGTWBJB-UHFFFAOYSA-N |