N-(4-chlorophenyl)-2-[(3-hydroxypropyl)amino]-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-[(3-hydroxypropyl)amino]-3,5-dinitrobenzamide
N-(4-chlorophenyl)-2-[(3-hydroxypropyl)amino]-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 1696-0260 |
| Compound Name: | N-(4-chlorophenyl)-2-[(3-hydroxypropyl)amino]-3,5-dinitrobenzamide |
| Molecular Weight: | 394.77 |
| Molecular Formula: | C16 H15 Cl N4 O6 |
| Smiles: | C(CNc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)C(Nc1ccc(cc1)[Cl])=O)CO |
| Stereo: | ACHIRAL |
| logP: | 2.2495 |
| logD: | 1.9421 |
| logSw: | -3.3486 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 115.399 |
| InChI Key: | AIGMBDJCESQVEW-UHFFFAOYSA-N |