8-(benzyloxy)-1-methyl-4-nitro-1H-benzo[b]furo[4,3,2-ef][1]benzoxepine
Chemical Structure Depiction of
8-(benzyloxy)-1-methyl-4-nitro-1H-benzo[b]furo[4,3,2-ef][1]benzoxepine
8-(benzyloxy)-1-methyl-4-nitro-1H-benzo[b]furo[4,3,2-ef][1]benzoxepine
Compound characteristics
| Compound ID: | 8018-0690 |
| Compound Name: | 8-(benzyloxy)-1-methyl-4-nitro-1H-benzo[b]furo[4,3,2-ef][1]benzoxepine |
| Molecular Weight: | 387.39 |
| Molecular Formula: | C23 H17 N O5 |
| Smiles: | CC1C2=Cc3ccc(cc3Oc3cc(cc(c23)O1)[N+]([O-])=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7275 |
| logD: | 5.7275 |
| logSw: | -5.6305 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.01 |
| InChI Key: | ODTXRUBNFOBZJY-CQSZACIVSA-N |