N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Chemical Structure Depiction of
N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide
N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Compound characteristics
| Compound ID: | 1502-1289 |
| Compound Name: | N-[3-{[(furan-2-yl)methyl]amino}-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide |
| Molecular Weight: | 405.41 |
| Molecular Formula: | C22 H19 N3 O5 |
| Smiles: | Cc1ccc(cc1)C(NC(=C\c1cccc(c1)[N+]([O-])=O)\C(NCc1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9304 |
| logD: | 2.9218 |
| logSw: | -3.9478 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.707 |
| InChI Key: | ZMBTYMCCUGUWTK-UHFFFAOYSA-N |