N-benzyl-5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Chemical Structure Depiction of
N-benzyl-5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
N-benzyl-5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Compound characteristics
| Compound ID: | 6940-0003 |
| Compound Name: | N-benzyl-5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine |
| Molecular Weight: | 422.55 |
| Molecular Formula: | C26 H22 N4 S |
| Smiles: | C1CCc2c(C1)c1c3c(c(NCc4ccccc4)ncn3)sc1nc2c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4698 |
| logD: | 6.4689 |
| logSw: | -6.5114 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.548 |
| InChI Key: | TYEKSBLWOCOKTF-UHFFFAOYSA-N |