8,8-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Chemical Structure Depiction of
8,8-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
8,8-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | F081-0794 |
| Compound Name: | 8,8-dimethyl-4-[(2-methylprop-2-en-1-yl)sulfanyl]-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
| Molecular Weight: | 357.49 |
| Molecular Formula: | C18 H19 N3 O S2 |
| Smiles: | CC(=C)CSc1c2c(c3cc4COC(C)(C)Cc4nc3s2)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 4.9435 |
| logD: | 4.939 |
| logSw: | -4.7891 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.504 |
| InChI Key: | YIBOTQBPTGWJNZ-UHFFFAOYSA-N |