3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-(4-ethoxyphenyl)-4-fluorobenzamide
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-(4-ethoxyphenyl)-4-fluorobenzamide
3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-(4-ethoxyphenyl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | K781-6936 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-N-(4-ethoxyphenyl)-4-fluorobenzamide |
| Molecular Weight: | 454.52 |
| Molecular Formula: | C24 H23 F N2 O4 S |
| Smiles: | CCOc1ccc(cc1)NC(c1ccc(c(c1)S(N1CCc2ccccc2C1)(=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7319 |
| logD: | 4.7263 |
| logSw: | -4.2817 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.826 |
| InChI Key: | VTIMNQNEGTUFEQ-UHFFFAOYSA-N |