N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroquinazoline-6-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroquinazoline-6-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroquinazoline-6-carboxamide
Compound characteristics
Compound ID: | T828-0210 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroquinazoline-6-carboxamide |
Molecular Weight: | 380.45 |
Molecular Formula: | C21 H24 N4 O3 |
Smiles: | C1CCN(C1)c1ncc2CC(CCc2n1)C(NCc1ccc2c(c1)OCO2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4783 |
logD: | 2.4781 |
logSw: | -2.8298 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 65.027 |
InChI Key: | DXVRZRXOAPZLEL-HNNXBMFYSA-N |