2-(morpholine-4-carbothioyl)phenyl 3-nitrobenzoate
Chemical Structure Depiction of
2-(morpholine-4-carbothioyl)phenyl 3-nitrobenzoate
2-(morpholine-4-carbothioyl)phenyl 3-nitrobenzoate
Compound characteristics
| Compound ID: | 3405-0163 |
| Compound Name: | 2-(morpholine-4-carbothioyl)phenyl 3-nitrobenzoate |
| Molecular Weight: | 372.4 |
| Molecular Formula: | C18 H16 N2 O5 S |
| Smiles: | C1COCCN1C(c1ccccc1OC(c1cccc(c1)[N+]([O-])=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 3.0928 |
| logD: | 3.0928 |
| logSw: | -3.6693 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.941 |
| InChI Key: | IBISNWSJGIZYHI-UHFFFAOYSA-N |