N~1~-{2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide
Chemical Structure Depiction of
N~1~-{2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide
N~1~-{2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide
Compound characteristics
| Compound ID: | 8008-9893 |
| Compound Name: | N~1~-{2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethyl}-N~2~-(4-fluorophenyl)ethanediamide |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C23 H27 F N4 O5 |
| Smiles: | COc1ccc(cc1OC)C(N1CCN(CCNC(C(Nc2ccc(cc2)F)=O)=O)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7128 |
| logD: | -0.4929 |
| logSw: | -2.0191 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.556 |
| InChI Key: | TWHLCTWKBDLIHL-UHFFFAOYSA-N |