Chemical Component Summary

Name(4R)-4-methyl-7-[(1R)-1-phenylethoxy]-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Identifiers(4~{R})-4-methyl-7-[(1~{R})-1-phenylethoxy]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
FormulaC18 H20 N2 O2
Molecular Weight296.364
TypeNON-POLYMER
Isomeric SMILESC[C@@H]1CC(=O)Nc2ccc(cc2N1)O[C@H](C)c3ccccc3
InChIInChI=1S/C18H20N2O2/c1-12-10-18(21)20-16-9-8-15(11-17(16)19-12)22-13(2)14-6-4-3-5-7-14/h3-9,11-13,19H,10H2,1-2H3,(H,20,21)/t12-,13-/m1/s1
InChIKeyORPRVEZBBPKRRY-CHWSQXEVSA-N

Chemical Details

Formal Charge0
Atom Count42
Chiral Atom Count2
Bond Count44
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 121271705
ChEMBL CHEMBL3814772