200,000+ products from a single source!
sales@angenechem.com
284681-58-9 | 4-Pyrimidinamine, 2-[(2-amino-4-chlorophenyl)thio]-6-(1-methylpropoxy)-
CAS No: 284681-58-9 Catalog No: AG002VEN MDL No:
Product Description
Catalog Number:
AG002VEN
Chemical Name:
4-Pyrimidinamine, 2-[(2-amino-4-chlorophenyl)thio]-6-(1-methylpropoxy)-
CAS Number:
284681-58-9
Molecular Formula:
C14H17ClN4OS
Molecular Weight:
324.8290
IUPAC Name:
2-(2-amino-4-chlorophenyl)sulfanyl-6-butan-2-yloxypyrimidin-4-amine
InChI:
InChI=1S/C14H17ClN4OS/c1-3-8(2)20-13-7-12(17)18-14(19-13)21-11-5-4-9(15)6-10(11)16/h4-8H,3,16H2,1-2H3,(H2,17,18,19)
InChI Key:
JRIOREGEACUPQJ-UHFFFAOYSA-N
SMILES:
CCC(Oc1nc(nc(c1)N)Sc1ccc(cc1N)Cl)C
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.081g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
324.827g/mol
Monoisotopic Mass:
324.081g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Structure-activity relationship studies on potential non-nucleoside DABO-like inhibitors of HIV-1 reverse transcriptase. | Antiviral chemistry & chemotherapy 20000301 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.