1-{4-[2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carbonyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carbonyl]piperazin-1-yl}ethan-1-one
1-{4-[2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carbonyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V012-6502 |
| Compound Name: | 1-{4-[2-({4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}methyl)-1,3-oxazole-4-carbonyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C23 H29 N5 O5 |
| Salt: | not_available |
| Smiles: | CC(N1CCN(CC1)C(c1coc(CN2CCN(CC2)Cc2ccc3c(c2)OCO3)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.448 |
| logD: | -0.7715 |
| logSw: | -1.6316 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.877 |
| InChI Key: | XETCXZOMLRGGDG-UHFFFAOYSA-N |