2-{[(4-fluorophenyl)methyl]amino}-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N-(3-methoxyphenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]amino}-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N-(3-methoxyphenyl)benzene-1-sulfonamide
2-{[(4-fluorophenyl)methyl]amino}-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N-(3-methoxyphenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | K659-0754 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]amino}-5-[4-(4-fluorophenyl)piperazine-1-carbonyl]-N-(3-methoxyphenyl)benzene-1-sulfonamide |
| Molecular Weight: | 592.66 |
| Molecular Formula: | C31 H30 F2 N4 O4 S |
| Smiles: | COc1cccc(c1)NS(c1cc(ccc1NCc1ccc(cc1)F)C(N1CCN(CC1)c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7319 |
| logD: | 4.2463 |
| logSw: | -4.5162 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.877 |
| InChI Key: | YURSZSXWMAPZSL-UHFFFAOYSA-N |