8-(benzylsulfanyl)-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Chemical Structure Depiction of
8-(benzylsulfanyl)-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
8-(benzylsulfanyl)-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
Compound ID: | 8640-0644 |
Compound Name: | 8-(benzylsulfanyl)-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
Molecular Weight: | 459.59 |
Molecular Formula: | C25 H21 N3 O2 S2 |
Smiles: | C[C@]1(C)Cc2c(CO1)c(c1ccco1)nc1c2c2c(c(ncn2)SCc2ccccc2)s1 |
Stereo: | ACHIRAL |
logP: | 6.0502 |
logD: | 6.0502 |
logSw: | -6.0296 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 46.809 |
InChI Key: | AAERPSABLDHQFY-UHFFFAOYSA-N |