N-(4-{2-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide
Chemical Structure Depiction of
N-(4-{2-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide
N-(4-{2-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide
Compound characteristics
| Compound ID: | K940-0500 |
| Compound Name: | N-(4-{2-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]acetamido}-2,5-dimethoxyphenyl)benzamide |
| Molecular Weight: | 556.61 |
| Molecular Formula: | C27 H29 F N4 O6 S |
| Smiles: | COc1cc(c(cc1NC(CN1CCN(CC1)S(c1ccc(cc1)F)(=O)=O)=O)OC)NC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3573 |
| logD: | 3.3349 |
| logSw: | -3.7288 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.596 |
| InChI Key: | VUCIVRTVIMTGFG-UHFFFAOYSA-N |