N-{4-(dimethylamino)-3-[(2-ethyl-N-propylbutanamido)methyl]phenyl}-4-nitrobenzamide
Chemical Structure Depiction of
N-{4-(dimethylamino)-3-[(2-ethyl-N-propylbutanamido)methyl]phenyl}-4-nitrobenzamide
N-{4-(dimethylamino)-3-[(2-ethyl-N-propylbutanamido)methyl]phenyl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | V010-3252 |
| Compound Name: | N-{4-(dimethylamino)-3-[(2-ethyl-N-propylbutanamido)methyl]phenyl}-4-nitrobenzamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C25 H34 N4 O4 |
| Salt: | not_available |
| Smiles: | CCCN(Cc1cc(ccc1N(C)C)NC(c1ccc(cc1)[N+]([O-])=O)=O)C(C(CC)CC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3434 |
| logD: | 5.3412 |
| logSw: | -5.2928 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.676 |
| InChI Key: | OLWLVGDFGMLNKK-UHFFFAOYSA-N |