N-benzyl-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(thiophen-2-yl)methyl]acetamide
Chemical Structure Depiction of
N-benzyl-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(thiophen-2-yl)methyl]acetamide
N-benzyl-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(thiophen-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C066-4377 |
| Compound Name: | N-benzyl-2-(8-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)-N-[(thiophen-2-yl)methyl]acetamide |
| Molecular Weight: | 442.54 |
| Molecular Formula: | C25 H22 N4 O2 S |
| Smiles: | Cc1ccc2c(c1)c1C=NN(CC(N(Cc3ccccc3)Cc3cccs3)=O)C(c1[nH]2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6355 |
| logD: | 3.6355 |
| logSw: | -4.0215 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.142 |
| InChI Key: | AYSAFVKKKPTVFY-UHFFFAOYSA-N |