N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V011-0197 |
| Compound Name: | N-{3-[benzyl(methyl)carbamoyl]-4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 594.64 |
| Molecular Formula: | C34 H31 F N4 O5 |
| Salt: | not_available |
| Smiles: | CN(Cc1ccccc1)C(c1cc(ccc1N1CCN(CC1)C(c1ccccc1F)=O)NC(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0408 |
| logD: | 5.0408 |
| logSw: | -4.6075 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.203 |
| InChI Key: | MAWJQUNYTMGMJO-UHFFFAOYSA-N |