5-butyl-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Chemical Structure Depiction of
5-butyl-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
5-butyl-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Compound characteristics
| Compound ID: | 6940-0238 |
| Compound Name: | 5-butyl-N-[(oxolan-2-yl)methyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine |
| Molecular Weight: | 396.55 |
| Molecular Formula: | C22 H28 N4 O S |
| Smiles: | CCCCc1c2CCCCc2c2c3c(c(NCC4CCCO4)ncn3)sc2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6258 |
| logD: | 5.6239 |
| logSw: | -5.5662 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.969 |
| InChI Key: | FPRNBMWSHPQXSU-CQSZACIVSA-N |