methyl 2-{2-[3-(2,3-dihydro-1H-indole-1-carbonyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[3-(2,3-dihydro-1H-indole-1-carbonyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzoate
methyl 2-{2-[3-(2,3-dihydro-1H-indole-1-carbonyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | L702-0227 |
| Compound Name: | methyl 2-{2-[3-(2,3-dihydro-1H-indole-1-carbonyl)-6-oxopyridazin-1(6H)-yl]acetamido}benzoate |
| Molecular Weight: | 432.43 |
| Molecular Formula: | C23 H20 N4 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C(C=CC(C(N2CCc3ccccc23)=O)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2247 |
| logD: | 2.2189 |
| logSw: | -3.008 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.123 |
| InChI Key: | REXNYHDHDQYOMF-UHFFFAOYSA-N |