methyl {[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetate
methyl {[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | 8640-0634 |
| Compound Name: | methyl {[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetate |
| Molecular Weight: | 431.57 |
| Molecular Formula: | C21 H25 N3 O3 S2 |
| Smiles: | CC(C)Cc1c2CO[C@@](C)(C)Cc2c2c3c(c(ncn3)SCC(=O)OC)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.051 |
| logD: | 5.051 |
| logSw: | -4.8096 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.848 |
| InChI Key: | PYVORJXQTJOZIL-UHFFFAOYSA-N |