200,000+ products from a single source!
sales@angenechem.com
118353-05-2 | 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1R,4S)-4-(hydroxymethyl)-2-cyclopenten-1-yl]-, rel-
CAS No: 118353-05-2 Catalog No: AG000IP2 MDL No:MFCD00870178
Product Description
Catalog Number:
AG000IP2
Chemical Name:
6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1R,4S)-4-(hydroxymethyl)-2-cyclopenten-1-yl]-, rel-
CAS Number:
118353-05-2
Molecular Formula:
C11H13N5O2
Molecular Weight:
247.2532
MDL Number:
MFCD00870178
IUPAC Name:
2-amino-9-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-1H-purin-6-one
InChI:
InChI=1S/C11H13N5O2/c12-11-14-9-8(10(18)15-11)13-5-16(9)7-2-1-6(3-7)4-17/h1-2,5-7,17H,3-4H2,(H3,12,14,15,18)/t6-,7+/m0/s1
InChI Key:
XSSYCIGJYCVRRK-NKWVEPMBSA-N
SMILES:
OC[C@@H]1C=C[C@@H](C1)n1cnc2c1nc(N)[nH]c2=O
UNII:
CPG1J3583K
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
247.107g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
247.258g/mol
Monoisotopic Mass:
247.107g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Literature
| Title | Journal |
|---|---|
| Asymmetric synthesis and antiviral activities of L-carbocyclic 2', 3'-didehydro-2',3'-dideoxy and 2',3'-dideoxy nucleosides. | Journal of medicinal chemistry 19990826 |
| Activities of (-)-carbovir and 3'-azido-3'-deoxythymidine against human immunodeficiency virus in vitro. | Antimicrobial agents and chemotherapy 19900601 |
| Resolution of racemic carbovir and selective inhibition of human immunodeficiency virus by the (-) enantiomer. | Biochemical and biophysical research communications 19900516 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.