N~2~-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)-N~1~,N~1~-diethylethane-1,2-diamine
Chemical Structure Depiction of
N~2~-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)-N~1~,N~1~-diethylethane-1,2-diamine
N~2~-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)-N~1~,N~1~-diethylethane-1,2-diamine
Compound characteristics
Compound ID: | 8640-0617 |
Compound Name: | N~2~-(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)-N~1~,N~1~-diethylethane-1,2-diamine |
Molecular Weight: | 427.61 |
Molecular Formula: | C23 H33 N5 O S |
Smiles: | CCCc1c2CO[C@](C)(C)Cc2c2c3c(c(NCCN(CC)CC)ncn3)sc2n1 |
Stereo: | ACHIRAL |
logP: | 5.5235 |
logD: | 3.5307 |
logSw: | -5.6397 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 53.536 |
InChI Key: | LLUWERNPAXWCKJ-UHFFFAOYSA-N |