2,2,4-trimethyl-N-(3-nitrophenyl)quinoline-1(2H)-carboxamide
Chemical Structure Depiction of
2,2,4-trimethyl-N-(3-nitrophenyl)quinoline-1(2H)-carboxamide
2,2,4-trimethyl-N-(3-nitrophenyl)quinoline-1(2H)-carboxamide
Compound characteristics
| Compound ID: | 3772-2560 |
| Compound Name: | 2,2,4-trimethyl-N-(3-nitrophenyl)quinoline-1(2H)-carboxamide |
| Molecular Weight: | 337.38 |
| Molecular Formula: | C19 H19 N3 O3 |
| Smiles: | CC1=CC(C)(C)N(C(Nc2cccc(c2)[N+]([O-])=O)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.7332 |
| logD: | 4.7332 |
| logSw: | -4.5726 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.526 |
| InChI Key: | STXFPBSHQJHYNP-UHFFFAOYSA-N |