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1241669-40-8 | 4(3H)-Pyrimidinone, 5-(2-hydroxyethyl)-6-methyl-2-[(4-piperidinylmethyl)amino]-
CAS No: 1241669-40-8 Catalog No: AG000LLD MDL No:
Product Description
Catalog Number:
AG000LLD
Chemical Name:
4(3H)-Pyrimidinone, 5-(2-hydroxyethyl)-6-methyl-2-[(4-piperidinylmethyl)amino]-
CAS Number:
1241669-40-8
Molecular Formula:
C13H22N4O2
Molecular Weight:
266.3394
IUPAC Name:
5-(2-hydroxyethyl)-4-methyl-2-(piperidin-4-ylmethylamino)-1H-pyrimidin-6-one
InChI:
InChI=1S/C13H22N4O2/c1-9-11(4-7-18)12(19)17-13(16-9)15-8-10-2-5-14-6-3-10/h10,14,18H,2-8H2,1H3,(H2,15,16,17,19)
InChI Key:
MUUBKCKAQXXTEA-UHFFFAOYSA-N
SMILES:
OCCc1c(C)nc([nH]c1=O)NCC1CCNCC1
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.174g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
266.345g/mol
Monoisotopic Mass:
266.174g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
85.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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