2-methoxy-7,7-dimethyl-4-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-10-sulfanylidene-7,10-dihydro[1,2]dithiolo[3,4-c]pyrrolo[3,2,1-ij]quinolin-5(4H)-one
Chemical Structure Depiction of
2-methoxy-7,7-dimethyl-4-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-10-sulfanylidene-7,10-dihydro[1,2]dithiolo[3,4-c]pyrrolo[3,2,1-ij]quinolin-5(4H)-one
2-methoxy-7,7-dimethyl-4-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-10-sulfanylidene-7,10-dihydro[1,2]dithiolo[3,4-c]pyrrolo[3,2,1-ij]quinolin-5(4H)-one
Compound characteristics
| Compound ID: | 8015-4026 |
| Compound Name: | 2-methoxy-7,7-dimethyl-4-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-10-sulfanylidene-7,10-dihydro[1,2]dithiolo[3,4-c]pyrrolo[3,2,1-ij]quinolin-5(4H)-one |
| Molecular Weight: | 464.62 |
| Molecular Formula: | C18 H12 N2 O3 S5 |
| Smiles: | CC1(C)C2=C(C(=S)SS2)c2cc(cc3\C(=C4/C(NC(=S)S4)=O)C(N1c23)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9413 |
| logD: | 0.5266 |
| logSw: | -3.5192 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.009 |
| InChI Key: | QARDGBCMNCSMGF-UHFFFAOYSA-N |