1-[2-fluoro-4-nitro-5-(pyrrolidin-1-yl)phenyl]azepane
Chemical Structure Depiction of
1-[2-fluoro-4-nitro-5-(pyrrolidin-1-yl)phenyl]azepane
1-[2-fluoro-4-nitro-5-(pyrrolidin-1-yl)phenyl]azepane
Compound characteristics
| Compound ID: | 5013-0011 |
| Compound Name: | 1-[2-fluoro-4-nitro-5-(pyrrolidin-1-yl)phenyl]azepane |
| Molecular Weight: | 307.37 |
| Molecular Formula: | C16 H22 F N3 O2 |
| Smiles: | C1CCCN(CC1)c1cc(c(cc1F)[N+]([O-])=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.1504 |
| logD: | 4.1504 |
| logSw: | -4.3739 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.319 |
| InChI Key: | KOJCXWQDVILXDW-UHFFFAOYSA-N |