2-ethoxy-4-(morpholine-4-carbothioyl)phenyl 4-nitrobenzoate
Chemical Structure Depiction of
2-ethoxy-4-(morpholine-4-carbothioyl)phenyl 4-nitrobenzoate
2-ethoxy-4-(morpholine-4-carbothioyl)phenyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 3405-0043 |
| Compound Name: | 2-ethoxy-4-(morpholine-4-carbothioyl)phenyl 4-nitrobenzoate |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C20 H20 N2 O6 S |
| Smiles: | CCOc1cc(ccc1OC(c1ccc(cc1)[N+]([O-])=O)=O)C(N1CCOCC1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.3982 |
| logD: | 3.3982 |
| logSw: | -3.8563 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.152 |
| InChI Key: | ISQPQLUXSRELCH-UHFFFAOYSA-N |