1-methyl-4-(4-nitrophenyl)-1,4-diazepane
Chemical Structure Depiction of
1-methyl-4-(4-nitrophenyl)-1,4-diazepane
1-methyl-4-(4-nitrophenyl)-1,4-diazepane
Compound characteristics
| Compound ID: | 8009-9197 |
| Compound Name: | 1-methyl-4-(4-nitrophenyl)-1,4-diazepane |
| Molecular Weight: | 235.28 |
| Molecular Formula: | C12 H17 N3 O2 |
| Smiles: | CN1CCCN(CC1)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.0251 |
| logD: | 1.482 |
| logSw: | -2.2661 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.88 |
| InChI Key: | XNADLAKKHYPORF-UHFFFAOYSA-N |