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606083-61-8 | Piperidine, 4-(1H-benzimidazol-2-yl)-1-(4-ethylbenzoyl)- (9CI)
CAS No: 606083-61-8 Catalog No: AG00EHQ5 MDL No:
Product Description
Catalog Number:
AG00EHQ5
Chemical Name:
Piperidine, 4-(1H-benzimidazol-2-yl)-1-(4-ethylbenzoyl)- (9CI)
CAS Number:
606083-61-8
IUPAC Name:
[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-(4-ethylphenyl)methanone
InChI:
InChI=1S/C21H23N3O/c1-2-15-7-9-17(10-8-15)21(25)24-13-11-16(12-14-24)20-22-18-5-3-4-6-19(18)23-20/h3-10,16H,2,11-14H2,1H3,(H,22,23)
InChI Key:
VSPWFCGSNWJWLR-UHFFFAOYSA-N
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.184g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.435g/mol
Monoisotopic Mass:
333.184g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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