2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide
Compound characteristics
Compound ID: | F081-1014 |
Compound Name: | 2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)sulfanyl]-N-(4-methoxyphenyl)acetamide |
Molecular Weight: | 466.58 |
Molecular Formula: | C23 H22 N4 O3 S2 |
Smiles: | CC1(C)Cc2c(CO1)cc1c3c(c(ncn3)SCC(Nc3ccc(cc3)OC)=O)sc1n2 |
Stereo: | ACHIRAL |
logP: | 4.6479 |
logD: | 4.6433 |
logSw: | -4.5056 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.926 |
InChI Key: | MOKUKZKJFUSGFW-UHFFFAOYSA-N |