(3-methoxyphenyl){4-[(2-nitrophenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1)
Chemical Structure Depiction of
(3-methoxyphenyl){4-[(2-nitrophenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1)
(3-methoxyphenyl){4-[(2-nitrophenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 3381-0319 |
| Compound Name: | (3-methoxyphenyl){4-[(2-nitrophenyl)methyl]piperazin-1-yl}methanone--oxalic acid (1/1) |
| Molecular Weight: | 445.43 |
| Molecular Formula: | C19 H21 N3 O4 |
| Salt: | HOOCCOOH |
| Smiles: | COc1cccc(c1)C(N1CCN(CC1)Cc1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4105 |
| logD: | 2.4063 |
| logSw: | -2.7038 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.051 |
| InChI Key: | UXAYPTFJHVQVRI-UHFFFAOYSA-N |