N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-methylpiperazine-1-sulfonyl)methyl]benzamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-methylpiperazine-1-sulfonyl)methyl]benzamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-methylpiperazine-1-sulfonyl)methyl]benzamide
Compound characteristics
| Compound ID: | Y300-1051 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(4-methylpiperazine-1-sulfonyl)methyl]benzamide |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C21 H25 N3 O5 S |
| Smiles: | CN1CCN(CC1)S(Cc1ccc(cc1)C(Nc1ccc2c(c1)OCCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5945 |
| logD: | 0.5432 |
| logSw: | -2.4663 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.235 |
| InChI Key: | WKOSBNUPNSIHTG-UHFFFAOYSA-N |