6-Amino-1,2,4-triazine-3,5(2H,4H)-dione - CAS 18802-38-5
Catalog: |
BB014483 |
Product Name: |
6-Amino-1,2,4-triazine-3,5(2H,4H)-dione |
CAS: |
18802-38-5 |
Synonyms: |
6-amino-2H-1,2,4-triazine-3,5-dione; 6-amino-2H-1,2,4-triazine-3,5-dione |
IUPAC Name: | 6-amino-2H-1,2,4-triazine-3,5-dione |
Description: | 6-Amino-1,2,4-triazine-3,5(2H,4H)-dione (CAS# 18802-38-5) is a useful research chemical. |
Molecular Weight: | 128.09 |
Molecular Formula: | C3H4N4O2 |
Canonical SMILES: | C1(=NNC(=O)NC1=O)N |
InChI: | InChI=1S/C3H4N4O2/c4-1-2(8)5-3(9)7-6-1/h(H2,4,6)(H2,5,7,8,9) |
InChI Key: | GFJDLRANNRSMCK-UHFFFAOYSA-N |
Density: | 2.22 g/cm3 |
MDL: | MFCD01346678 |
LogP: | -1.37840 |
Publication Number | Title | Priority Date |
EP-3497111-A2 | Substituted nucleosides, nucleotides and analogs thereof | 20160812 |
JP-2019524795-A | Substituted nucleosides, nucleotides, and analogs thereof | 20160812 |
US-2019169221-A1 | Substituted nucleosides, nucleotides and analogs thereof | 20160812 |
WO-2018031818-A2 | Substituted nucleosides, nucleotides and analogs thereof | 20160812 |
US-2013131057-A1 | New bicyclic compounds as pi3-k and mtor inhibitors | 20100513 |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 128.03342538 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 128.03342538 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 96.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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