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155054-42-5 | Benzamide, 4-iodo-N-[2-(1-piperidinyl)ethyl]-
CAS No: 155054-42-5 Catalog No: AG001NKP MDL No:
Product Description
Catalog Number:
AG001NKP
Chemical Name:
Benzamide, 4-iodo-N-[2-(1-piperidinyl)ethyl]-
CAS Number:
155054-42-5
Molecular Formula:
C14H19IN2O
Molecular Weight:
358.2179
IUPAC Name:
4-iodo-N-(2-piperidin-1-ylethyl)benzamide
InChI:
InChI=1S/C14H19IN2O/c15-13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18)
InChI Key:
WCMWVYQHPUQKHW-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)I)NCCN1CCCCC1
NSC Number:
665366
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.054g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.223g/mol
Monoisotopic Mass:
358.054g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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