2-(3,5-dinitrophenyl)-4-({4-[methyl(phenyl)amino]phenyl}methylidene)-1,3-oxazol-5(4H)-one
Chemical Structure Depiction of
2-(3,5-dinitrophenyl)-4-({4-[methyl(phenyl)amino]phenyl}methylidene)-1,3-oxazol-5(4H)-one
2-(3,5-dinitrophenyl)-4-({4-[methyl(phenyl)amino]phenyl}methylidene)-1,3-oxazol-5(4H)-one
Compound characteristics
| Compound ID: | 8001-4534 |
| Compound Name: | 2-(3,5-dinitrophenyl)-4-({4-[methyl(phenyl)amino]phenyl}methylidene)-1,3-oxazol-5(4H)-one |
| Molecular Weight: | 444.4 |
| Molecular Formula: | C23 H16 N4 O6 |
| Smiles: | CN(c1ccccc1)c1ccc(/C=C2/C(=O)OC(c3cc(cc(c3)[N+]([O-])=O)[N+]([O-])=O)=N2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9385 |
| logD: | 3.9384 |
| logSw: | -4.0827 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 99.312 |
| InChI Key: | XIPLVJRZQYZIAW-UHFFFAOYSA-N |