10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
Chemical Structure Depiction of
10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol
Compound characteristics
| Compound ID: | 4333-3750 |
| Compound Name: | 10-ethyl-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol |
| Molecular Weight: | 352.5 |
| Molecular Formula: | C14 H16 N4 O S3 |
| Smiles: | CCC1(C)Cc2c3c4nnc(n4C(=Nc3sc2CO1)SC)S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1218 |
| logD: | 2.3344 |
| logSw: | -3.08 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.661 |
| InChI Key: | KGQPASCZDUDBRX-AWEZNQCLSA-N |