(azepan-1-yl){1-[(2-nitrophenyl)methyl]piperidin-3-yl}methanone--oxalic acid (1/1)
Chemical Structure Depiction of
(azepan-1-yl){1-[(2-nitrophenyl)methyl]piperidin-3-yl}methanone--oxalic acid (1/1)
(azepan-1-yl){1-[(2-nitrophenyl)methyl]piperidin-3-yl}methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | Y511-1305 |
| Compound Name: | (azepan-1-yl){1-[(2-nitrophenyl)methyl]piperidin-3-yl}methanone--oxalic acid (1/1) |
| Molecular Weight: | 435.48 |
| Molecular Formula: | C19 H27 N3 O3 |
| Salt: | HOOCCOOH |
| Smiles: | C1CCCN(CC1)C(C1CCCN(C1)Cc1ccccc1[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.052 |
| logD: | 2.697 |
| logSw: | -3.291 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.96 |
| InChI Key: | NBSQRBPEUUUBIU-KRWDZBQOSA-N |