2-(4-methylphenyl)-6-[4-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
Chemical Structure Depiction of
2-(4-methylphenyl)-6-[4-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
2-(4-methylphenyl)-6-[4-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | F977-0811 |
| Compound Name: | 2-(4-methylphenyl)-6-[4-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)-1,4-diazepan-1-yl]pyridazin-3(2H)-one |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C24 H28 N6 O2 |
| Smiles: | Cc1ccc(cc1)N1C(C=CC(=N1)N1CCCN(CC1)C(c1c2CCCCc2[nH]n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7144 |
| logD: | 2.7143 |
| logSw: | -3.1236 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.445 |
| InChI Key: | LEGUBSMPDGCNBS-UHFFFAOYSA-N |