1-(3-nitrophenyl)-3-{4-[(pyridin-4-yl)methyl]anilino}propan-1-one
Chemical Structure Depiction of
1-(3-nitrophenyl)-3-{4-[(pyridin-4-yl)methyl]anilino}propan-1-one
1-(3-nitrophenyl)-3-{4-[(pyridin-4-yl)methyl]anilino}propan-1-one
Compound characteristics
| Compound ID: | 8003-9260 |
| Compound Name: | 1-(3-nitrophenyl)-3-{4-[(pyridin-4-yl)methyl]anilino}propan-1-one |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C21 H19 N3 O3 |
| Smiles: | C(CNc1ccc(Cc2ccncc2)cc1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7456 |
| logD: | 3.7445 |
| logSw: | -4.0478 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.1 |
| InChI Key: | DGHIOOFDQOASIH-UHFFFAOYSA-N |