N-(3,4-dichlorophenyl)-2-fluoro-5-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-sulfonyl)benzamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-2-fluoro-5-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-sulfonyl)benzamide
N-(3,4-dichlorophenyl)-2-fluoro-5-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-sulfonyl)benzamide
Compound characteristics
| Compound ID: | K781-8987 |
| Compound Name: | N-(3,4-dichlorophenyl)-2-fluoro-5-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-sulfonyl)benzamide |
| Molecular Weight: | 536.41 |
| Molecular Formula: | C24 H20 Cl2 F N3 O4 S |
| Smiles: | C1C2CN3C(=CC=CC3=O)C1CN(C2)S(c1ccc(c(c1)C(Nc1ccc(c(c1)[Cl])[Cl])=O)F)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2465 |
| logD: | 3.7685 |
| logSw: | -5.7092 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.74 |
| InChI Key: | BLKOLWJMVCWNOZ-UHFFFAOYSA-N |