4-methyl-N-(3-methylbutyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-methyl-N-(3-methylbutyl)-3-nitrobenzamide
4-methyl-N-(3-methylbutyl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-0790 |
| Compound Name: | 4-methyl-N-(3-methylbutyl)-3-nitrobenzamide |
| Molecular Weight: | 250.3 |
| Molecular Formula: | C13 H18 N2 O3 |
| Smiles: | CC(C)CCNC(c1ccc(C)c(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0614 |
| logD: | 3.0614 |
| logSw: | -3.3403 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.845 |
| InChI Key: | LHPPZWKOBIAWFR-UHFFFAOYSA-N |