2-nitro-N-{[4-(propan-2-yl)phenyl]methyl}-N-(pyridin-2-yl)benzamide
Chemical Structure Depiction of
2-nitro-N-{[4-(propan-2-yl)phenyl]methyl}-N-(pyridin-2-yl)benzamide
2-nitro-N-{[4-(propan-2-yl)phenyl]methyl}-N-(pyridin-2-yl)benzamide
Compound characteristics
Compound ID: | D341-0800 |
Compound Name: | 2-nitro-N-{[4-(propan-2-yl)phenyl]methyl}-N-(pyridin-2-yl)benzamide |
Molecular Weight: | 375.43 |
Molecular Formula: | C22 H21 N3 O3 |
Smiles: | CC(C)c1ccc(CN(C(c2ccccc2[N+]([O-])=O)=O)c2ccccn2)cc1 |
Stereo: | ACHIRAL |
logP: | 5.0604 |
logD: | 5.0604 |
logSw: | -4.6147 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 57.181 |
InChI Key: | RJORFMVFXJCGLY-UHFFFAOYSA-N |