3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | D144-0404 |
| Compound Name: | 3-[2-(4-methoxyphenyl)ethyl]-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 387.43 |
| Molecular Formula: | C24 H21 N O4 |
| Smiles: | COc1ccc(CCN2Cc3c(ccc4c5ccccc5C(=O)Oc34)OC2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2657 |
| logD: | 4.2158 |
| logSw: | -5.033 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.679 |
| InChI Key: | NCQLEFFILIFVEK-UHFFFAOYSA-N |