N-{4-[(10-butyl-3-nitro-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-1-yl)oxy]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[(10-butyl-3-nitro-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-1-yl)oxy]phenyl}acetamide
N-{4-[(10-butyl-3-nitro-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-1-yl)oxy]phenyl}acetamide
Compound characteristics
| Compound ID: | 8013-0297 |
| Compound Name: | N-{4-[(10-butyl-3-nitro-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-1-yl)oxy]phenyl}acetamide |
| Molecular Weight: | 461.47 |
| Molecular Formula: | C25 H23 N3 O6 |
| Smiles: | CCCCN1C(c2c(cc(cc2Oc2ccccc12)[N+]([O-])=O)Oc1ccc(cc1)NC(C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9979 |
| logD: | 4.9979 |
| logSw: | -4.6529 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.293 |
| InChI Key: | RZENDXKMRVOKRF-UHFFFAOYSA-N |