4-chloro-3-nitro-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-chloro-3-nitro-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}benzamide
4-chloro-3-nitro-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | 8016-3381 |
| Compound Name: | 4-chloro-3-nitro-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}benzamide |
| Molecular Weight: | 355.78 |
| Molecular Formula: | C18 H14 Cl N3 O3 |
| Smiles: | C(c1ccc(cc1)n1cccc1)NC(c1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7155 |
| logD: | 3.7146 |
| logSw: | -4.2901 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.718 |
| InChI Key: | XDGWTPBUJFTWOF-UHFFFAOYSA-N |