Home Carbonyls 3-(((Benzyloxy)carbonyl)amino)-3-(piperidin-4-yl)propanoic acid

3-(((Benzyloxy)carbonyl)amino)-3-(piperidin-4-yl)propanoic acid

CAS No.:
372144-06-4
Catalog Number:
AG003I7A
Molecular Formula:
C16H22N2O4
Molecular Weight:
306.3569
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Product Description
Catalog Number:
AG003I7A
Chemical Name:
3-(((Benzyloxy)carbonyl)amino)-3-(piperidin-4-yl)propanoic acid
CAS Number:
372144-06-4
Molecular Formula:
C16H22N2O4
Molecular Weight:
306.3569
MDL Number:
MFCD03425244
IUPAC Name:
3-(phenylmethoxycarbonylamino)-3-piperidin-4-ylpropanoic acid
InChI:
InChI=1S/C16H22N2O4/c19-15(20)10-14(13-6-8-17-9-7-13)18-16(21)22-11-12-4-2-1-3-5-12/h1-5,13-14,17H,6-11H2,(H,18,21)(H,19,20)
InChI Key:
UHDGOUUGHMJUST-UHFFFAOYSA-N
SMILES:
O=C(NC(C1CCNCC1)CC(=O)O)OCc1ccccc1
Properties
Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.158g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
306.362g/mol
Monoisotopic Mass:
306.158g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Properties