N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-phenylsulfuric diamide
Chemical Structure Depiction of
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-phenylsulfuric diamide
N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-phenylsulfuric diamide
Compound characteristics
| Compound ID: | 7582-3113 |
| Compound Name: | N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-2-oxoethyl)-N',N'-dimethyl-N-phenylsulfuric diamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C22 H28 N4 O5 S |
| Smiles: | CN(C)S(N(CC(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3769 |
| logD: | 1.1853 |
| logSw: | -2.4309 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.199 |
| InChI Key: | MXHXUACPQUWNOT-UHFFFAOYSA-N |