1-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]piperidine-4-carboxamide
1-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | 3785-0395 |
| Compound Name: | 1-[2-(8-methoxy-4,4-dimethyl-1-sulfanylidene-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)-2-oxoethyl]piperidine-4-carboxamide |
| Molecular Weight: | 463.64 |
| Molecular Formula: | C21 H25 N3 O3 S3 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc(ccc2N1C(CN1CCC(CC1)C(N)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0549 |
| logD: | 2.0397 |
| logSw: | -3.0252 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.514 |
| InChI Key: | QNVBDQANWDWKTR-UHFFFAOYSA-N |