9-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
9-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
9-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | Y031-6563 |
| Compound Name: | 9-[(5-amino-1,3,4-thiadiazol-2-yl)methyl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 293.3 |
| Molecular Formula: | C10 H11 N7 O2 S |
| Smiles: | CN1C(c2c(N(C)C1=O)n(Cc1nnc(N)s1)cn2)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6781 |
| logD: | -0.6782 |
| logSw: | -0.9854 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.701 |
| InChI Key: | QKDYPRKPEWPUOK-UHFFFAOYSA-N |