3-{4-(morpholin-4-yl)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-yl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
3-{4-(morpholin-4-yl)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-yl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
3-{4-(morpholin-4-yl)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-yl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | 8014-1982 |
| Compound Name: | 3-{4-(morpholin-4-yl)-6-[(propan-2-yl)amino]-1,3,5-triazin-2-yl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 411.51 |
| Molecular Formula: | C21 H29 N7 O2 |
| Smiles: | CC(C)Nc1nc(nc(n1)N1CC2CC(C1)C1=CC=CC(N1C2)=O)N1CCOCC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8645 |
| logD: | 3.8642 |
| logSw: | -3.8655 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.086 |
| InChI Key: | QAPAITJEMFGVAZ-UHFFFAOYSA-N |