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1417794-32-1 | Acetamide, 2-chloro-N-[1-(6-chloro-4-pyrimidinyl)-4-piperidinyl]-
CAS No: 1417794-32-1 Catalog No: AG001H55 MDL No:MFCD22631697
Product Description
Catalog Number:
AG001H55
Chemical Name:
Acetamide, 2-chloro-N-[1-(6-chloro-4-pyrimidinyl)-4-piperidinyl]-
CAS Number:
1417794-32-1
Molecular Formula:
C11H14Cl2N4O
Molecular Weight:
289.1611
MDL Number:
MFCD22631697
IUPAC Name:
2-chloro-N-[1-(6-chloropyrimidin-4-yl)piperidin-4-yl]acetamide
InChI:
InChI=1S/C11H14Cl2N4O/c12-6-11(18)16-8-1-3-17(4-2-8)10-5-9(13)14-7-15-10/h5,7-8H,1-4,6H2,(H,16,18)
InChI Key:
DHFHMJKIXVBTNS-UHFFFAOYSA-N
SMILES:
ClCC(=O)NC1CCN(CC1)c1ncnc(c1)Cl
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.054g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.16g/mol
Monoisotopic Mass:
288.054g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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