N-[(furan-2-yl)methyl]-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
N-[(furan-2-yl)methyl]-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V027-5431 |
| Compound Name: | N-[(furan-2-yl)methyl]-N-(2-{4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl}-2-oxoethyl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 539.59 |
| Molecular Formula: | C30 H29 N5 O5 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)c1ccc(nn1)N1CCN(CC1)C(CN(Cc1ccco1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8486 |
| logD: | 3.8279 |
| logSw: | -3.8516 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.63 |
| InChI Key: | LVRGDORGFUWKAK-UHFFFAOYSA-N |