4-[(4-bromophenyl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]-3-nitrobenzamide
Chemical Structure Depiction of
4-[(4-bromophenyl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]-3-nitrobenzamide
4-[(4-bromophenyl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-2408 |
| Compound Name: | 4-[(4-bromophenyl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]-3-nitrobenzamide |
| Molecular Weight: | 480.38 |
| Molecular Formula: | C20 H22 Br N3 O4 S |
| Smiles: | C(CNC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccc(cc1)[Br])=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.0691 |
| logD: | 3.6809 |
| logSw: | -4.1816 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.193 |
| InChI Key: | FEMYVHLBJGJAMB-UHFFFAOYSA-N |