4-(hexylsulfanyl)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Chemical Structure Depiction of
4-(hexylsulfanyl)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
4-(hexylsulfanyl)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | F081-0997 |
| Compound Name: | 4-(hexylsulfanyl)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
| Molecular Weight: | 401.59 |
| Molecular Formula: | C21 H27 N3 O S2 |
| Smiles: | CCCCCCSc1c2c(c3cc4COC(C)(C)Cc4nc3s2)nc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.7255 |
| logD: | 6.7222 |
| logSw: | -5.6955 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.878 |
| InChI Key: | RRBCFVFPHDRSHU-UHFFFAOYSA-N |