3-(4-tert-butylbenzamido)-N-ethyl-N-(3-methylphenyl)-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
3-(4-tert-butylbenzamido)-N-ethyl-N-(3-methylphenyl)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide
3-(4-tert-butylbenzamido)-N-ethyl-N-(3-methylphenyl)-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: | K781-1560 |
| Compound Name: | 3-(4-tert-butylbenzamido)-N-ethyl-N-(3-methylphenyl)-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)benzamide |
| Molecular Weight: | 602.78 |
| Molecular Formula: | C38 H42 N4 O3 |
| Smiles: | CCN(C(c1ccc(c(c1)NC(c1ccc(cc1)C(C)(C)C)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O)c1cccc(C)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.8094 |
| logD: | 7.6307 |
| logSw: | -5.585 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.83 |
| InChI Key: | LTSKYPSMQFTDAG-UHFFFAOYSA-N |