3-(4-methylpyridin-2-yl)-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-(4-methylpyridin-2-yl)-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-(4-methylpyridin-2-yl)-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | E754-0470 |
| Compound Name: | 3-(4-methylpyridin-2-yl)-3,4,7,8,9,10-hexahydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C21 H20 N2 O3 |
| Smiles: | Cc1ccnc(c1)N1Cc2c(ccc3C4CCCCC=4C(=O)Oc23)OC1 |
| Stereo: | ACHIRAL |
| logP: | 4.6006 |
| logD: | 4.5772 |
| logSw: | -4.5138 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.581 |
| InChI Key: | NXMJALNJRMJBQB-UHFFFAOYSA-N |