(8-methoxy-4,4-dimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate
Chemical Structure Depiction of
(8-methoxy-4,4-dimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate
(8-methoxy-4,4-dimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate
Compound characteristics
| Compound ID: | Y021-3306 |
| Compound Name: | (8-methoxy-4,4-dimethyl-1,2-dioxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate |
| Molecular Weight: | 431.57 |
| Molecular Formula: | C21 H25 N3 O3 S2 |
| Smiles: | CC1(C)C=C(CSC(N2CCN(C)CC2)=S)c2cc(cc3C(C(N1c23)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.0839 |
| logD: | 2.279 |
| logSw: | -3.3974 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 43.68 |
| InChI Key: | JJOSKMSZMUICMQ-UHFFFAOYSA-N |