N-(morpholine-4-carbothioyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(morpholine-4-carbothioyl)-4-nitrobenzamide
N-(morpholine-4-carbothioyl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 1492-0127 |
| Compound Name: | N-(morpholine-4-carbothioyl)-4-nitrobenzamide |
| Molecular Weight: | 295.31 |
| Molecular Formula: | C12 H13 N3 O4 S |
| Smiles: | C1COCCN1C(NC(c1ccc(cc1)[N+]([O-])=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 1.3567 |
| logD: | 1.3563 |
| logSw: | -2.377 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.605 |
| InChI Key: | KBQNYCRXGJDAIJ-UHFFFAOYSA-N |