N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(ethanesulfonyl)amino]-2-[4-(2-fluorophenyl)piperazin-1-yl]benzene-1-sulfonamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(ethanesulfonyl)amino]-2-[4-(2-fluorophenyl)piperazin-1-yl]benzene-1-sulfonamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(ethanesulfonyl)amino]-2-[4-(2-fluorophenyl)piperazin-1-yl]benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V014-7625 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-5-[(ethanesulfonyl)amino]-2-[4-(2-fluorophenyl)piperazin-1-yl]benzene-1-sulfonamide |
| Molecular Weight: | 576.67 |
| Molecular Formula: | C26 H29 F N4 O6 S2 |
| Salt: | not_available |
| Smiles: | CCS(Nc1ccc(c(c1)S(NCc1ccc2c(c1)OCO2)(=O)=O)N1CCN(CC1)c1ccccc1F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5496 |
| logD: | 4.4069 |
| logSw: | -4.2495 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 107.771 |
| InChI Key: | UUGWBBTYCHDYIL-UHFFFAOYSA-N |