3,5-dinitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
Chemical Structure Depiction of
3,5-dinitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
3,5-dinitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | 8003-9287 |
| Compound Name: | 3,5-dinitro-N-{[4-(propan-2-yl)phenyl]methyl}benzamide |
| Molecular Weight: | 343.34 |
| Molecular Formula: | C17 H17 N3 O5 |
| Smiles: | CC(C)c1ccc(CNC(c2cc(cc(c2)[N+]([O-])=O)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9895 |
| logD: | 3.9854 |
| logSw: | -4.1092 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.415 |
| InChI Key: | KRODDNLFJIWFRN-UHFFFAOYSA-N |