(1R,2R)-2-[4-(5-Methyl-1H-pyrazol-3-yl)benzoyl]-N-(4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)cyclohexanecarboxamide | CAS No. 2041075-86-7

(1R,2R)-2-[4-(5-Methyl-1H-pyrazol-3-yl)benzoyl]-N-(4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)cyclohexanecarboxamide

Basic Information

CAS Number

2041075-86-7

Molecular Formula

C24H26N6O3

Molecular Weight

446.51 g/mol

AD

Basic Physical Properties

CC1=CC(=NN1)C1C=CC(=CC=1)C(=O)[C@@H]1CCCC[C@H]1C(=O)NC1C=NN2CCNC(=O)C2=1

InChI

InChI=1S/C24H26N6O3/c1-14-12-19(29-28-14)15-6-8-16(9-7-15)22(31)17-4-2-3-5-18(17)23(32)27-20-13-26-30-11-10-25-24(33)21(20)30/h6-9,12-13,17-18H,2-5,10-11H2,1H3,(H,25,33)(H,27,32)(H,28,29)/t17-,18-/m1/s1

InChIKey

ROTWSDMXHVGAHZ-QZTJIDSGSA-N

LogP

2.95282

Topological Polar Surface Area

121.76999999999998 Ų

Hydrogen Bond Donor/Acceptor

3 / 9

Complexity

755

Synonyms & References

English

  • AZD5718
  • (1R,2R)-2-(4-(5-Methyl-1H-pyrazol-3-yl)benzoyl)-N-(4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl)cyclohexane-1-carboxamide
  • GTPL10352
  • US10183947, Example 7
  • BDBM323023
  • BDBM50524102
  • compound 12 [PMID: 30869888]
  • (1R,2R)-2-[4-(3-Methyl-1H-pyrazol-5- yl)benzoyl]-N-(4-oxo-4,5,6,7- tetrahydropyrazolo[1,5-a]pyrazin-3- yl)cyclohexanecarboxamide
  • (1R,2R)-2-[4-(5-methyl-1H-pyrazol-3-yl)benzoyl]-N-(4-oxo-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-3-yl)cycloh
  • Chembl4542281
  • Atuliflapon

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