N-benzyl-2,2,5-trimethyl-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Chemical Structure Depiction of
N-benzyl-2,2,5-trimethyl-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
N-benzyl-2,2,5-trimethyl-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Compound characteristics
Compound ID: | 8640-0683 |
Compound Name: | N-benzyl-2,2,5-trimethyl-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine |
Molecular Weight: | 436.6 |
Molecular Formula: | C23 H24 N4 O S2 |
Smiles: | Cc1c2COC(C)(C)Cc2c2c3c(c(NCc4ccccc4)nc(n3)SC)sc2n1 |
Stereo: | ACHIRAL |
logP: | 5.7465 |
logD: | 5.7463 |
logSw: | -5.9127 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.806 |
InChI Key: | QIIZOOJONDKJMA-UHFFFAOYSA-N |