2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]acetamide
2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | C880-0701 |
| Compound Name: | 2-(5-benzyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(3-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C27 H24 N4 O3 |
| Smiles: | COc1cccc(CNC(CN2C(c3c(C=N2)c2ccccc2n3Cc2ccccc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9469 |
| logD: | 3.9469 |
| logSw: | -4.248 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.087 |
| InChI Key: | LSHDVIWHZLLVHE-UHFFFAOYSA-N |