N-[2-(2,5-dimethoxyphenyl)ethyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]propanamide
Chemical Structure Depiction of
N-[2-(2,5-dimethoxyphenyl)ethyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]propanamide
N-[2-(2,5-dimethoxyphenyl)ethyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | C700-1011 |
| Compound Name: | N-[2-(2,5-dimethoxyphenyl)ethyl]-2-[(2-nitrothiophen-3-yl)sulfanyl]propanamide |
| Molecular Weight: | 396.48 |
| Molecular Formula: | C17 H20 N2 O5 S2 |
| Smiles: | CC(C(NCCc1cc(ccc1OC)OC)=O)Sc1ccsc1[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4007 |
| logD: | 3.4007 |
| logSw: | -3.7642 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.118 |
| InChI Key: | KVWAKMHDJZAFRD-NSHDSACASA-N |