ethyl 4-[(8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]benzoate
Chemical Structure Depiction of
ethyl 4-[(8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]benzoate
ethyl 4-[(8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]benzoate
Compound characteristics
| Compound ID: | 4060-0084 |
| Compound Name: | ethyl 4-[(8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]benzoate |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C22 H22 N2 O3 S2 |
| Smiles: | CCOC(c1ccc(cc1)/N=C1/C2=C(C(C)(C)Nc3ccc(cc23)OC)SS1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3709 |
| logD: | 5.3709 |
| logSw: | -5.4318 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.922 |
| InChI Key: | NRTJQOFWXCZPGT-UHFFFAOYSA-N |