N~1~,N~1~-dimethyl-N~3~-[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]propane-1,3-diamine
Chemical Structure Depiction of
N~1~,N~1~-dimethyl-N~3~-[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]propane-1,3-diamine
N~1~,N~1~-dimethyl-N~3~-[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]propane-1,3-diamine
Compound characteristics
| Compound ID: | 6940-0144 |
| Compound Name: | N~1~,N~1~-dimethyl-N~3~-[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]propane-1,3-diamine |
| Molecular Weight: | 383.56 |
| Molecular Formula: | C21 H29 N5 S |
| Smiles: | CC(C)c1c2CCCCc2c2c3c(c(NCCCN(C)C)ncn3)sc2n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2305 |
| logD: | 3.2948 |
| logSw: | -5.1042 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.798 |
| InChI Key: | PUZOIBKFMPSYMD-UHFFFAOYSA-N |