200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 88338-98-1
88338-98-1 | 1H-Purine-2,6-dione, 3,7-dihydro-7-(5-hydroxypentyl)-1,3-dimethyl-
CAS No: 88338-98-1 Catalog No: AG0047WY MDL No:
Product Description
Catalog Number:
AG0047WY
Chemical Name:
1H-Purine-2,6-dione, 3,7-dihydro-7-(5-hydroxypentyl)-1,3-dimethyl-
CAS Number:
88338-98-1
Molecular Formula:
C12H18N4O3
Molecular Weight:
266.2963
IUPAC Name:
7-(5-hydroxypentyl)-1,3-dimethylpurine-2,6-dione
InChI:
InChI=1S/C12H18N4O3/c1-14-10-9(11(18)15(2)12(14)19)16(8-13-10)6-4-3-5-7-17/h8,17H,3-7H2,1-2H3
InChI Key:
QSLWCYSLTRAPQF-UHFFFAOYSA-N
SMILES:
OCCCCCn1cnc2c1c(=O)n(C)c(=O)n2C
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.138g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.301g/mol
Monoisotopic Mass:
266.138g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.