3-benzyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Chemical Structure Depiction of
3-benzyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
3-benzyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one
Compound characteristics
| Compound ID: | D144-0097 |
| Compound Name: | 3-benzyl-3,4-dihydro-2H,6H-[2]benzopyrano[3,4-f][1,3]benzoxazin-6-one |
| Molecular Weight: | 343.38 |
| Molecular Formula: | C22 H17 N O3 |
| Smiles: | C(c1ccccc1)N1Cc2c(ccc3c4ccccc4C(=O)Oc23)OC1 |
| Stereo: | ACHIRAL |
| logP: | 4.103 |
| logD: | 4.0772 |
| logSw: | -5.2538 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.157 |
| InChI Key: | DPPWDHKFIITPLQ-UHFFFAOYSA-N |