N-methyl-N-(3-nitrodibenzo[b,f]oxepin-1-yl)acetamide
Chemical Structure Depiction of
N-methyl-N-(3-nitrodibenzo[b,f]oxepin-1-yl)acetamide
N-methyl-N-(3-nitrodibenzo[b,f]oxepin-1-yl)acetamide
Compound characteristics
| Compound ID: | 8016-0401 |
| Compound Name: | N-methyl-N-(3-nitrodibenzo[b,f]oxepin-1-yl)acetamide |
| Molecular Weight: | 310.31 |
| Molecular Formula: | C17 H14 N2 O4 |
| Smiles: | CC(N(C)c1cc(cc2c1C=Cc1ccccc1O2)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0999 |
| logD: | 3.0999 |
| logSw: | -3.5508 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.572 |
| InChI Key: | DAVQCKZAEJVSCQ-UHFFFAOYSA-N |