4-phenyl-9-[(3,4,5-trimethoxyphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Chemical Structure Depiction of
4-phenyl-9-[(3,4,5-trimethoxyphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
4-phenyl-9-[(3,4,5-trimethoxyphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one
Compound characteristics
| Compound ID: | D144-0043 |
| Compound Name: | 4-phenyl-9-[(3,4,5-trimethoxyphenyl)methyl]-9,10-dihydro-2H,8H-pyrano[2,3-f][1,3]benzoxazin-2-one |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C27 H25 N O6 |
| Smiles: | COc1cc(CN2Cc3c(ccc4C(=CC(=O)Oc34)c3ccccc3)OC2)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1282 |
| logD: | 2.7113 |
| logSw: | -4.4238 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.621 |
| InChI Key: | DVAQUYKXFMAKHH-UHFFFAOYSA-N |