AC1NKIJS
2-[4-[[1-(1-adamantyl)-5-chloro-6-oxopyridazin-4-yl]amino]phenyl]acetic acid
Also Known As: SR-01000134291-1|2-[4-[[1-(1-adamantyl)-5-chloro-6-oxo-pyridazin-4-yl]amino]phenyl]acetic Acid|2-[4-[[1-(1-adamantyl)-5-chloro-6-oxopyridazin-4-yl]amino]phenyl]acetic acid|(4-{[5-chloro-6-oxo-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,6-dihydropyridazin-4-yl]amino}phenyl)acetic acid|2-(4-((1-((3s,5s,7s)-adamantan-1-yl)-5-chloro-6-oxo-1,6-dihydropyridazin-4-yl)amino)phenyl)acetic acid|2-(4-{[1-(ADAMANTAN-1-YL)-5-CHLORO-6-OXO-1,6-DIHYDROPYRIDAZIN-4-YL]AMINO}PHENYL)ACETIC ACID
| Molecular Formula | C22H24ClN3O3 |
|---|---|
| Molecular Weight | 413.1506 g/mol |
| LogP | 4.1927 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.1506 |
| Monoisotopic Mass | 413.1506 |
| Heavy Atoms | 29 |
| Complexity | 979.66864 |
Chemical Identifiers
| CAS Number | 896833-66-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)N4C(=O)C(=C(C=N4)NC5=CC=C(C=C5)CC(=O)O)Cl |
Product Overview
AC1NKIJS (CAS 896833-66-2), with molecular formula C22H24ClN3O3 and molecular weight 413.1506 g/mol. IUPAC: 2-[4-[[1-(1-adamantyl)-5-chloro-6-oxopyridazin-4-yl]amino]phenyl]acetic acid.
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