200,000+ products from a single source!
sales@angenechem.com
1137475-40-1 | 2-Pyrazinecarbonitrile, 5-[[6-[(3-methoxypropyl)amino]-4-pyrimidinyl]amino]-
CAS No: 1137475-40-1 Catalog No: AG0009K2 MDL No:
Product Description
Catalog Number:
AG0009K2
Chemical Name:
2-Pyrazinecarbonitrile, 5-[[6-[(3-methoxypropyl)amino]-4-pyrimidinyl]amino]-
CAS Number:
1137475-40-1
Molecular Formula:
C13H15N7O
Molecular Weight:
285.3045
IUPAC Name:
5-[[6-(3-methoxypropylamino)pyrimidin-4-yl]amino]pyrazine-2-carbonitrile
InChI:
InChI=1S/C13H15N7O/c1-21-4-2-3-15-11-5-12(19-9-18-11)20-13-8-16-10(6-14)7-17-13/h5,7-9H,2-4H2,1H3,(H2,15,17,18,19,20)
InChI Key:
GBWPUKNIOFXBNB-UHFFFAOYSA-N
SMILES:
COCCCNc1cc(Nc2cnc(cn2)C#N)ncn1
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.134g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.311g/mol
Monoisotopic Mass:
285.134g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.