4QF

(5R,7S)-8-benzyl-4-(cyclohexylamino)-1-(3-fluorophenyl)-7-methyl-1,3,8-triazaspiro[4.5]dec-3-en-2-one


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Chemical Component Summary

Name(5R,7S)-8-benzyl-4-(cyclohexylamino)-1-(3-fluorophenyl)-7-methyl-1,3,8-triazaspiro[4.5]dec-3-en-2-one
Identifiers(5R,7S)-4-(cyclohexylamino)-1-(3-fluorophenyl)-7-methyl-8-(phenylmethyl)-1,3,8-triazaspiro[4.5]dec-3-en-2-one
FormulaC27 H33 F N4 O
Molecular Weight448.576
TypeNON-POLYMER
Isomeric SMILESC[C@H]1C[C@]2(CCN1Cc3ccccc3)C(=NC(=O)N2c4cccc(c4)F)NC5CCCCC5
InChIInChI=1S/C27H33FN4O/c1-20-18-27(15-16-31(20)19-21-9-4-2-5-10-21)25(29-23-12-6-3-7-13-23)30-26(33)32(27)24-14-8-11-22(28)17-24/h2,4-5,8-11,14,17,20,23H,3,6-7,12-13,15-16,18-19H2,1H3,(H,29,30,33)/t20-,27+/m0/s1
InChIKeyYNODVOARUZZRMG-CCLHPLFOSA-N

Chemical Details

Formal Charge0
Atom Count66
Chiral Atom Count2
Bond Count70
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 136652638, 91267056