2-[(pyridine-3-carbonyl)amino]ethyl 4-nitrobenzoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[(pyridine-3-carbonyl)amino]ethyl 4-nitrobenzoate--hydrogen chloride (1/1)
2-[(pyridine-3-carbonyl)amino]ethyl 4-nitrobenzoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 0051-2450 |
| Compound Name: | 2-[(pyridine-3-carbonyl)amino]ethyl 4-nitrobenzoate--hydrogen chloride (1/1) |
| Molecular Weight: | 351.74 |
| Molecular Formula: | C15 H13 N3 O5 |
| Salt: | HCl |
| Smiles: | C(COC(c1ccc(cc1)[N+]([O-])=O)=O)NC(c1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9704 |
| logD: | 1.9704 |
| logSw: | -1.9556 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.44 |
| InChI Key: | IOFRXSAMZKOXKO-UHFFFAOYSA-N |