N-(butan-2-yl)-3-[(4-ethylphenyl)carbamamido]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
Chemical Structure Depiction of
N-(butan-2-yl)-3-[(4-ethylphenyl)carbamamido]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
N-(butan-2-yl)-3-[(4-ethylphenyl)carbamamido]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
Compound characteristics
| Compound ID: | K784-8027 |
| Compound Name: | N-(butan-2-yl)-3-[(4-ethylphenyl)carbamamido]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide |
| Molecular Weight: | 527.67 |
| Molecular Formula: | C31 H37 N5 O3 |
| Smiles: | CCC(C)NC(c1ccc(c(c1)NC(Nc1ccc(CC)cc1)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5721 |
| logD: | 5.5713 |
| logSw: | -5.3597 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.82 |
| InChI Key: | AXZKTWSVJULINH-UHFFFAOYSA-N |