1-[4-(4-acetyl-5-phenyl-2H-1,3-dithiol-2-ylidene)-2,2,6-trimethyl-3-sulfanylidene-3,4-dihydroquinolin-1(2H)-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(4-acetyl-5-phenyl-2H-1,3-dithiol-2-ylidene)-2,2,6-trimethyl-3-sulfanylidene-3,4-dihydroquinolin-1(2H)-yl]ethan-1-one
1-[4-(4-acetyl-5-phenyl-2H-1,3-dithiol-2-ylidene)-2,2,6-trimethyl-3-sulfanylidene-3,4-dihydroquinolin-1(2H)-yl]ethan-1-one
Compound characteristics
| Compound ID: | 3505-6186 |
| Compound Name: | 1-[4-(4-acetyl-5-phenyl-2H-1,3-dithiol-2-ylidene)-2,2,6-trimethyl-3-sulfanylidene-3,4-dihydroquinolin-1(2H)-yl]ethan-1-one |
| Molecular Weight: | 465.65 |
| Molecular Formula: | C25 H23 N O2 S3 |
| Smiles: | CC(C1=C(c2ccccc2)S/C(=C2C(C(C)(C)N(C(C)=O)c3ccc(C)cc\23)=S)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6575 |
| logD: | 5.6575 |
| logSw: | -5.5599 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 28.729 |
| InChI Key: | SVHOXNKIZQXFJZ-UHFFFAOYSA-N |