1-amino-N-[(oxolan-2-yl)methyl]-5-(pyrrolidin-1-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Chemical Structure Depiction of
1-amino-N-[(oxolan-2-yl)methyl]-5-(pyrrolidin-1-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
1-amino-N-[(oxolan-2-yl)methyl]-5-(pyrrolidin-1-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Compound characteristics
| Compound ID: | D396-0137 |
| Compound Name: | 1-amino-N-[(oxolan-2-yl)methyl]-5-(pyrrolidin-1-yl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C21 H28 N4 O2 S |
| Smiles: | C1CCc2c(C1)c1c(c(C(NCC3CCCO3)=O)sc1nc2N1CCCC1)N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6341 |
| logD: | 3.6335 |
| logSw: | -4.2051 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.085 |
| InChI Key: | LSUXAXFBYLFJOJ-CYBMUJFWSA-N |