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874801-03-3 | 3-(4-Benzylhomopiperazin-1-yl)propanoic acid
CAS No: 874801-03-3 Catalog No: AG01FGKC MDL No:
Product Description
Catalog Number:
AG01FGKC
Chemical Name:
3-(4-Benzylhomopiperazin-1-yl)propanoic acid
CAS Number:
874801-03-3
IUPAC Name:
3-(4-benzyl-1,4-diazepan-1-yl)propanoic acid
InChI:
InChI=1S/C15H22N2O2/c18-15(19)7-10-16-8-4-9-17(12-11-16)13-14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2,(H,18,19)
InChI Key:
AHEQNHHLPIGJGP-UHFFFAOYSA-N
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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