5-butyl-N-(2-phenylethyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Chemical Structure Depiction of
5-butyl-N-(2-phenylethyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
5-butyl-N-(2-phenylethyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Compound characteristics
| Compound ID: | 6940-0235 |
| Compound Name: | 5-butyl-N-(2-phenylethyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine |
| Molecular Weight: | 416.59 |
| Molecular Formula: | C25 H28 N4 S |
| Smiles: | CCCCc1c2CCCCc2c2c3c(c(NCCc4ccccc4)ncn3)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.1275 |
| logD: | 7.1256 |
| logSw: | -6.1137 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.156 |
| InChI Key: | GGXDBUNWYSZKTI-UHFFFAOYSA-N |