S-[(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro[1,3]thiazolo[2,3-f]purin-6-yl)methyl] O-ethyl carbonodithioate
Chemical Structure Depiction of
S-[(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro[1,3]thiazolo[2,3-f]purin-6-yl)methyl] O-ethyl carbonodithioate
S-[(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro[1,3]thiazolo[2,3-f]purin-6-yl)methyl] O-ethyl carbonodithioate
Compound characteristics
| Compound ID: | 8018-2671 |
| Compound Name: | S-[(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro[1,3]thiazolo[2,3-f]purin-6-yl)methyl] O-ethyl carbonodithioate |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C13 H14 N4 O3 S3 |
| Smiles: | CCOC(=S)SCC1=CSc2nc3c(C(N(C)C(N3C)=O)=O)n12 |
| Stereo: | ACHIRAL |
| logP: | 2.736 |
| logD: | 2.736 |
| logSw: | -2.7439 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 51.056 |
| InChI Key: | LSXJNMWBZKRWOV-UHFFFAOYSA-N |