N-(2-methoxy-4-nitrophenyl)-4,4,7,8-tetramethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine
Chemical Structure Depiction of
N-(2-methoxy-4-nitrophenyl)-4,4,7,8-tetramethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine
N-(2-methoxy-4-nitrophenyl)-4,4,7,8-tetramethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine
Compound characteristics
| Compound ID: | 3535-0321 |
| Compound Name: | N-(2-methoxy-4-nitrophenyl)-4,4,7,8-tetramethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-imine |
| Molecular Weight: | 427.54 |
| Molecular Formula: | C21 H21 N3 O3 S2 |
| Smiles: | Cc1cc2C3=C(C(C)(C)Nc2cc1C)SSC/3=N/c1ccc(cc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5128 |
| logD: | 5.5128 |
| logSw: | -5.5574 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.938 |
| InChI Key: | DSKSXACITUTATN-UHFFFAOYSA-N |