N-(2-bromophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide
Chemical Structure Depiction of
N-(2-bromophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide
N-(2-bromophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide
Compound characteristics
| Compound ID: | K781-7897 |
| Compound Name: | N-(2-bromophenyl)-5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-2-fluorobenzamide |
| Molecular Weight: | 489.36 |
| Molecular Formula: | C22 H18 Br F N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)S(c1ccc(c(c1)C(Nc1ccccc1[Br])=O)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9504 |
| logD: | 4.9259 |
| logSw: | -4.7503 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.005 |
| InChI Key: | VRWNGZBVEJCRNX-UHFFFAOYSA-N |