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Home > Pyridines > 1097163-83-1
1097163-83-1 | 2,5,6-trimethyl-7-[2-(pyridin-2-yl)ethyl]-1H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-imine
CAS No: 1097163-83-1 Catalog No: AG01AIQA MDL No:MFCD13660503
Product Description
Catalog Number:
AG01AIQA
Chemical Name:
2,5,6-trimethyl-7-[2-(pyridin-2-yl)ethyl]-1H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-imine
CAS Number:
1097163-83-1
Molecular Formula:
C16H19N5
Molecular Weight:
281.3556
MDL Number:
MFCD13660503
IUPAC Name:
2,5,6-trimethyl-7-(2-pyridin-2-ylethyl)pyrrolo[2,3-d]pyrimidin-4-amine
InChI:
InChI=1S/C16H19N5/c1-10-11(2)21(9-7-13-6-4-5-8-18-13)16-14(10)15(17)19-12(3)20-16/h4-6,8H,7,9H2,1-3H3,(H2,17,19,20)
InChI Key:
OZHZDKZJNQTISJ-UHFFFAOYSA-N
SMILES:
Cc1nc(=N)c2c([nH]1)n(CCc1ccccn1)c(c2C)C
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.164g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.363g/mol
Monoisotopic Mass:
281.164g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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