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823220-72-0 | Pyrimidine, 4-(1-piperidinyl)-2-(1-pyrrolidinyl)-6-[2-(1-pyrrolidinyl)ethyl]-
CAS No: 823220-72-0 Catalog No: AG004YWZ MDL No:
Product Description
Catalog Number:
AG004YWZ
Chemical Name:
Pyrimidine, 4-(1-piperidinyl)-2-(1-pyrrolidinyl)-6-[2-(1-pyrrolidinyl)ethyl]-
CAS Number:
823220-72-0
Molecular Formula:
C19H31N5
Molecular Weight:
329.4829
IUPAC Name:
4-piperidin-1-yl-2-pyrrolidin-1-yl-6-(2-pyrrolidin-1-ylethyl)pyrimidine
InChI:
InChI=1S/C19H31N5/c1-2-11-23(12-3-1)18-16-17(8-15-22-9-4-5-10-22)20-19(21-18)24-13-6-7-14-24/h16H,1-15H2
InChI Key:
IGYASWHHOVWCOW-UHFFFAOYSA-N
SMILES:
C1CCN(CC1)c1cc(CCN2CCCC2)nc(n1)N1CCCC1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.258g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.492g/mol
Monoisotopic Mass:
329.258g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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