6-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Chemical Structure Depiction of
6-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
6-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one
Compound characteristics
| Compound ID: | C890-0031 |
| Compound Name: | 6-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5,7-dimethyl-2-phenyl-2,6-dihydro-1H-pyrrolo[3,4-d]pyridazin-1-one |
| Molecular Weight: | 455.56 |
| Molecular Formula: | C27 H29 N5 O2 |
| Smiles: | Cc1c2C=NN(C(c2c(C)n1CC(N1CCN(CC1)Cc1ccccc1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.369 |
| logD: | 2.3536 |
| logSw: | -2.4755 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.441 |
| InChI Key: | XKARFLOWXHIUBJ-UHFFFAOYSA-N |