8,9-dimethyl-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Chemical Structure Depiction of
8,9-dimethyl-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
8,9-dimethyl-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one
Compound characteristics
| Compound ID: | F815-0212 |
| Compound Name: | 8,9-dimethyl-2-[2-(6-methyl-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-2-oxoethyl]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3(2H)-one |
| Molecular Weight: | 409.47 |
| Molecular Formula: | C20 H19 N5 O3 S |
| Smiles: | Cc1ccc2c(c1)N(CCO2)C(CN1C(N2C=Nc3c(C2=N1)c(C)c(C)s3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6483 |
| logD: | 2.6481 |
| logSw: | -2.8943 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 64.598 |
| InChI Key: | FTHDIEGFMMVNPT-UHFFFAOYSA-N |