2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}acetamide
Chemical Structure Depiction of
2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}acetamide
2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}acetamide
Compound characteristics
Compound ID: | Y044-5185 |
Compound Name: | 2-(2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl)-N-{2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}acetamide |
Molecular Weight: | 435.48 |
Molecular Formula: | C23 H25 N5 O4 |
Smiles: | C1[C@H]2CN(CCNC(CN3C(c4ccccc4NC3=O)=O)=O)C[C@@H]1CN1C2=CC=CC1=O |
Stereo: | ABSOLUTE |
logP: | 1.2297 |
logD: | 0.9266 |
logSw: | -2.2558 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 84.475 |
InChI Key: | QUHASTZWWUMLFV-HOTGVXAUSA-N |