3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-propylbenzamide
Chemical Structure Depiction of
3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-propylbenzamide
3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-propylbenzamide
Compound characteristics
| Compound ID: | K784-5794 |
| Compound Name: | 3-[(4-fluorobenzene-1-sulfonyl)amino]-4-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-N-propylbenzamide |
| Molecular Weight: | 524.61 |
| Molecular Formula: | C27 H29 F N4 O4 S |
| Smiles: | CCCNC(c1ccc(c(c1)NS(c1ccc(cc1)F)(=O)=O)N1CC2CC(C1)C1=CC=CC(N1C2)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8991 |
| logD: | 1.3889 |
| logSw: | -4.0878 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.567 |
| InChI Key: | FBOBQDQPLVPYDD-UHFFFAOYSA-N |