N-(2-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]anilino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(2-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]anilino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(2-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]anilino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V024-6772 |
| Compound Name: | N-(2-{4-[4-(2-fluorobenzoyl)piperazin-1-yl]anilino}-2-oxoethyl)-N-(propan-2-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 546.6 |
| Molecular Formula: | C30 H31 F N4 O5 |
| Salt: | not_available |
| Smiles: | CC(C)N(CC(Nc1ccc(cc1)N1CCN(CC1)C(c1ccccc1F)=O)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0509 |
| logD: | 4.0509 |
| logSw: | -4.1532 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.367 |
| InChI Key: | VRMDRUNIVYZWCK-UHFFFAOYSA-N |