4-(benzylsulfanyl)-N,N-diethyl-2,6-dinitrobenzamide
Chemical Structure Depiction of
4-(benzylsulfanyl)-N,N-diethyl-2,6-dinitrobenzamide
4-(benzylsulfanyl)-N,N-diethyl-2,6-dinitrobenzamide
Compound characteristics
| Compound ID: | 8010-5846 |
| Compound Name: | 4-(benzylsulfanyl)-N,N-diethyl-2,6-dinitrobenzamide |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C18 H19 N3 O5 S |
| Smiles: | CCN(CC)C(c1c(cc(cc1[N+]([O-])=O)SCc1ccccc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5467 |
| logD: | 3.5467 |
| logSw: | -4.1226 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.06 |
| InChI Key: | YXQMTNPDJPGVES-UHFFFAOYSA-N |