200,000+ products from a single source!
sales@angenechem.com
295341-56-9 | 1-Piperazinecarboxylic acid, 4-(1H-benzimidazol-2-yl)-, 1,1-dimethylethyl ester
CAS No: 295341-56-9 Catalog No: AG002YOK MDL No:
Product Description
Catalog Number:
AG002YOK
Chemical Name:
1-Piperazinecarboxylic acid, 4-(1H-benzimidazol-2-yl)-, 1,1-dimethylethyl ester
CAS Number:
295341-56-9
Molecular Formula:
C16H22N4O2
Molecular Weight:
302.3715
IUPAC Name:
tert-butyl 4-(1H-benzimidazol-2-yl)piperazine-1-carboxylate
InChI:
InChI=1S/C16H22N4O2/c1-16(2,3)22-15(21)20-10-8-19(9-11-20)14-17-12-6-4-5-7-13(12)18-14/h4-7H,8-11H2,1-3H3,(H,17,18)
InChI Key:
HFEQYXCCAIHIBP-UHFFFAOYSA-N
SMILES:
O=C(N1CCN(CC1)c1nc2c([nH]1)cccc2)OC(C)(C)C
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.174g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.378g/mol
Monoisotopic Mass:
302.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.