N-{3-[(4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl}benzamide
Chemical Structure Depiction of
N-{3-[(4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl}benzamide
N-{3-[(4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl}benzamide
Compound characteristics
| Compound ID: | 3785-0014 |
| Compound Name: | N-{3-[(4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene)amino]phenyl}benzamide |
| Molecular Weight: | 443.59 |
| Molecular Formula: | C25 H21 N3 O S2 |
| Smiles: | CC1(C)C2=C(/C(=N/c3cccc(c3)NC(c3ccccc3)=O)SS2)c2ccccc2N1 |
| Stereo: | ACHIRAL |
| logP: | 5.7383 |
| logD: | 5.7344 |
| logSw: | -5.5047 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.715 |
| InChI Key: | LTPPWWRXINQURG-UHFFFAOYSA-N |