4-methyl-N-[1-(3-nitrophenyl)-3-oxo-3-{[(oxolan-2-yl)methyl]amino}prop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-methyl-N-[1-(3-nitrophenyl)-3-oxo-3-{[(oxolan-2-yl)methyl]amino}prop-1-en-2-yl]benzamide
4-methyl-N-[1-(3-nitrophenyl)-3-oxo-3-{[(oxolan-2-yl)methyl]amino}prop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 1502-1290 |
| Compound Name: | 4-methyl-N-[1-(3-nitrophenyl)-3-oxo-3-{[(oxolan-2-yl)methyl]amino}prop-1-en-2-yl]benzamide |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C22 H23 N3 O5 |
| Smiles: | Cc1ccc(cc1)C(NC(=C\c1cccc(c1)[N+]([O-])=O)\C(NCC1CCCO1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7304 |
| logD: | 1.4329 |
| logSw: | -3.1872 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.612 |
| InChI Key: | VNZHREGXWAZLCY-LJQANCHMSA-N |