| Identification | Back Directory | [Name]
Cyclohexanecarboxylic acid, 4-[2-fluoro-4-methoxy-5-[[[(1S,2R,3S,4R)-3-[[[(1-methylcyclobutyl)methyl]amino]carbonyl]bicyclo[2.2.1]hept-2-yl]amino]carbonyl]phenoxy]-1-methyl-, cis- | [CAS]
2787501-83-9 | [Synonyms]
AZD5462
Cyclohexanecarboxylic acid, 4-[2-fluoro-4-methoxy-5-[[[(1S,2R,3S,4R)-3-[[[(1-methylcyclobutyl)methyl]amino]carbonyl]bicyclo[2.2.1]hept-2-yl]amino]carbonyl]phenoxy]-1-methyl-, cis- | [Molecular Formula]
C30H41FN2O6 | [MOL File]
2787501-83-9.mol | [Molecular Weight]
544.65 |
| Chemical Properties | Back Directory | [Boiling point ]
714.1±60.0 °C(Predicted) | [density ]
1.27±0.1 g/cm3(Predicted) | [solubility ]
Acetonitrile: Slightly Soluble: 0.1-1 mg/ml
DMSO: Sparingly Soluble: 1-10 mg/ml | [form ]
Solid | [pka]
4.87±0.44(Predicted) | [color ]
White to off-white | [InChIKey]
LYUYYIGCZIZIGF-SRHODNEWSA-N | [SMILES]
C1(C)(C(O)=O)CCC(OC2=CC(C(N[C@H]3[C@@H](C(NCC4(C)CCC4)=O)[C@@]4([H])C[C@]3([H])CC4)=O)=C(OC)C=C2F)CC1 |
| Hazard Information | Back Directory | [Uses]
AZD5462 is a RXFP1 modulator, can be used for heart failure research. RXFP1 is the cognate receptor for human relaxin, belongs to GPCR family 1c number with anti-fibrotic and anti-inflammatory properties[1]. | [References]
[1] Granberg Kenneth Lars, et al. 4-(2-Fluoro-4-methoxy-5-(3-(((1-methylcyclobutyl)methyl)carbamoyl)bicyclo[2.2.1]heptan-2-yl)carbamoyl)phenoxy)-1-methylcyclohexane-1-carboxylic acid derivatives and similar compounds as RXFP1 modulators for the treatment of heart failure and their preparation: World Intellectual Property Organization, WO2022122773. 2022-06-16. |
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