8-(benzylsulfanyl)-2,2-dimethyl-5-phenyl-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)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
8-(benzylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Compound characteristics
| Compound ID: | 5921-0004 |
| Compound Name: | 8-(benzylsulfanyl)-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine |
| Molecular Weight: | 469.63 |
| Molecular Formula: | C27 H23 N3 O S2 |
| Smiles: | CC1(C)Cc2c(CO1)c(c1ccccc1)nc1c2c2c(c(ncn2)SCc2ccccc2)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.7338 |
| logD: | 6.7338 |
| logSw: | -6.2666 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.231 |
| InChI Key: | FQBWQRZICBFDTP-UHFFFAOYSA-N |