1-[4-(4-acetyl-5-phenyl-2H-1,3-dithiol-2-ylidene)-2,2,6-trimethyl-3-sulfanylidene-3,4-dihydroquinolin-1(2H)-yl]-2-phenylethan-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]-2-phenylethan-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]-2-phenylethan-1-one
Compound characteristics
| Compound ID: | 3505-6187 |
| 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]-2-phenylethan-1-one |
| Molecular Weight: | 541.75 |
| Molecular Formula: | C31 H27 N O2 S3 |
| Smiles: | CC(C1=C(c2ccccc2)S/C(=C2C(C(C)(C)N(C(Cc3ccccc3)=O)c3ccc(C)cc\23)=S)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2598 |
| logD: | 7.2598 |
| logSw: | -5.6988 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 27.4621 |
| InChI Key: | LYNOYOXWMKJAJA-UHFFFAOYSA-N |