{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone
Chemical Structure Depiction of
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone
{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone
Compound characteristics
| Compound ID: | 4606-3709 |
| Compound Name: | {4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C23 H23 N3 O4 |
| Smiles: | Cc1c(C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)=O)c(c2ccccc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.7277 |
| logD: | 2.5361 |
| logSw: | -3.0167 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.503 |
| InChI Key: | YPJCGFMDAMLIKX-UHFFFAOYSA-N |