N-(3-ethoxypropyl)-4-[(4-fluorophenyl)sulfanyl]-3-nitrobenzamide
Chemical Structure Depiction of
N-(3-ethoxypropyl)-4-[(4-fluorophenyl)sulfanyl]-3-nitrobenzamide
N-(3-ethoxypropyl)-4-[(4-fluorophenyl)sulfanyl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-5559 |
| Compound Name: | N-(3-ethoxypropyl)-4-[(4-fluorophenyl)sulfanyl]-3-nitrobenzamide |
| Molecular Weight: | 378.42 |
| Molecular Formula: | C18 H19 F N2 O4 S |
| Smiles: | CCOCCCNC(c1ccc(c(c1)[N+]([O-])=O)Sc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0648 |
| logD: | 4.0648 |
| logSw: | -4.1969 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.551 |
| InChI Key: | XRWIMFCTVMLCMK-UHFFFAOYSA-N |