1333210-07-3
4-(((1R,2R)-2-((R)-3-aminopiperidin-1-yl)-2,3-dihydro-1H-inden-1-yl)oxy)-3-chlorobenzonitrile
Name4-(((1R,2R)-2-((R)-3-aminopiperidin-1-yl)-2,3-dihydro-1H-inden-1-yl)oxy)-3-chlorobenzonitrile
1Identification
【Name】
4-(((1R,2R)-2-((R)-3-aminopiperidin-1-yl)-2,3-dihydro-1H-inden-1-yl)oxy)-3-chlorobenzonitrile
【CAS】
【MDL】
【English Synonyms】
【Formula】
C21H22ClN3O
【MolWeight】
367.872
【Inchi】
InChI=1S/C21H22ClN3O/c22-18-10-14(12-23)7-8-20(18)26-21-17-6-2-1-4-15(17)11-19(21)25-9-3-5-16(24)13-25/h1-2,4,6-8,10,16,19,21H,3,5,9,11,13,24H2/t16-,19-,21-/m1/s1
【InChIKey】
InChIKey=RLKRLNQEXBPQGQ-OZOXKJRCSA-N
【SMILES】
N[C@H]1CN(CCC1)[C@H]1[C@@H](C2=CC=CC=C2C1)OC1=C(C=C(C#N)C=C1)Cl
【MOL File】
4-(((1R,2R)-2-((R)-3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
4-(((1R,2R)-2-((R)-3-aminopiperidin-1-yl)-2,3-dihydro-1H-inden-1-yl)oxy)-3-chlorobenzonitrile.cml