N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
Compound ID: | E213-0789 |
Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2-carboxamide |
Molecular Weight: | 422.55 |
Molecular Formula: | C23 H26 N4 O2 S |
Smiles: | Cc1c2C(N3CCCCC3=Nc2sc1C(NCCN1CCc2ccccc2C1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.5954 |
logD: | 2.3868 |
logSw: | -2.9434 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.19 |
InChI Key: | XXZXLQFFSLIDHU-UHFFFAOYSA-N |