N-[2-(3,4-dimethoxyphenyl)ethyl]-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]acetamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-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]acetamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-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]acetamide
Compound characteristics
| Compound ID: | F081-1114 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-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]acetamide |
| Molecular Weight: | 524.66 |
| Molecular Formula: | C26 H28 N4 O4 S2 |
| Smiles: | CC1(C)Cc2c(CO1)cc1c3c(c(ncn3)SCC(NCCc3ccc(c(c3)OC)OC)=O)sc1n2 |
| Stereo: | ACHIRAL |
| logP: | 3.6386 |
| logD: | 3.6341 |
| logSw: | -4.0002 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.806 |
| InChI Key: | YRMJNJJIEWMMLC-UHFFFAOYSA-N |