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89758-34-9 | 1-Pyrrolidinebutanamide, N-(5-phenyl-1,3,4-oxadiazol-2-yl)-
CAS No: 89758-34-9 Catalog No: AG0040Q7 MDL No:
Product Description
Catalog Number:
AG0040Q7
Chemical Name:
1-Pyrrolidinebutanamide, N-(5-phenyl-1,3,4-oxadiazol-2-yl)-
CAS Number:
89758-34-9
Molecular Formula:
C16H20N4O2
Molecular Weight:
300.3556
IUPAC Name:
N-(5-phenyl-1,3,4-oxadiazol-2-yl)-4-pyrrolidin-1-ylbutanamide
InChI:
InChI=1S/C16H20N4O2/c21-14(9-6-12-20-10-4-5-11-20)17-16-19-18-15(22-16)13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2,(H,17,19,21)
InChI Key:
ZWKFPYKKVTWMKD-UHFFFAOYSA-N
SMILES:
O=C(Nc1nnc(o1)c1ccccc1)CCCN1CCCC1
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.159g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
300.362g/mol
Monoisotopic Mass:
300.159g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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