N~3~-(5-butyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)-N~1~,N~1~-dimethylpropane-1,3-diamine
Chemical Structure Depiction of
N~3~-(5-butyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)-N~1~,N~1~-dimethylpropane-1,3-diamine
N~3~-(5-butyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)-N~1~,N~1~-dimethylpropane-1,3-diamine
Compound characteristics
| Compound ID: | 6940-0242 |
| Compound Name: | N~3~-(5-butyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)-N~1~,N~1~-dimethylpropane-1,3-diamine |
| Molecular Weight: | 397.58 |
| Molecular Formula: | C22 H31 N5 S |
| Smiles: | CCCCc1c2CCCCc2c2c3c(c(NCCCN(C)C)ncn3)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.536 |
| logD: | 3.6004 |
| logSw: | -5.5794 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.294 |
| InChI Key: | ONKNSLCOWGNOLR-UHFFFAOYSA-N |