2-(benzylsulfanyl)-6,6-dimethyl-4-(pyrrolidin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Chemical Structure Depiction of
2-(benzylsulfanyl)-6,6-dimethyl-4-(pyrrolidin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
2-(benzylsulfanyl)-6,6-dimethyl-4-(pyrrolidin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | 8640-0088 |
| Compound Name: | 2-(benzylsulfanyl)-6,6-dimethyl-4-(pyrrolidin-1-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine |
| Molecular Weight: | 411.59 |
| Molecular Formula: | C22 H25 N3 O S2 |
| Smiles: | CC1(C)Cc2c3c(nc(nc3sc2CO1)SCc1ccccc1)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 6.0249 |
| logD: | 6.0241 |
| logSw: | -5.8405 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.7338 |
| InChI Key: | NIMCTGAVIGYPDS-UHFFFAOYSA-N |