4-benzyl-1-{[5-(3-nitrophenyl)-2H-tetrazol-2-yl]methyl}piperidine
Chemical Structure Depiction of
4-benzyl-1-{[5-(3-nitrophenyl)-2H-tetrazol-2-yl]methyl}piperidine
4-benzyl-1-{[5-(3-nitrophenyl)-2H-tetrazol-2-yl]methyl}piperidine
Compound characteristics
| Compound ID: | D153-0134 |
| Compound Name: | 4-benzyl-1-{[5-(3-nitrophenyl)-2H-tetrazol-2-yl]methyl}piperidine |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C20 H22 N6 O2 |
| Smiles: | C1CN(CCC1Cc1ccccc1)Cn1nc(c2cccc(c2)[N+]([O-])=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 4.4501 |
| logD: | 4.4497 |
| logSw: | -4.489 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 76.878 |
| InChI Key: | YHWKJSSUNURHNY-UHFFFAOYSA-N |