58N

(4R)-6-(1-tert-butyl-1H-pyrazol-4-yl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one


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Chemical Component Summary

Name(4R)-6-(1-tert-butyl-1H-pyrazol-4-yl)-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Identifiers(4R)-6-(1-tert-butylpyrazol-4-yl)-4-methyl-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
FormulaC17 H22 N4 O
Molecular Weight298.383
TypeNON-POLYMER
Isomeric SMILESC[C@@H]1CC(=O)Nc2cccc(c2N1)c3cnn(c3)C(C)(C)C
InChIInChI=1S/C17H22N4O/c1-11-8-15(22)20-14-7-5-6-13(16(14)19-11)12-9-18-21(10-12)17(2,3)4/h5-7,9-11,19H,8H2,1-4H3,(H,20,22)/t11-/m1/s1
InChIKeyHPSNXSAYALRMQW-LLVKDONJSA-N

Chemical Details

Formal Charge0
Atom Count44
Chiral Atom Count1
Bond Count46
Aromatic Bond Count11

Related Resource References

Resource NameReference
Pharos CHEMBL4207557
PubChem 121277860
ChEMBL CHEMBL4207557