2-Amino-5-methoxypyrimidine-4,6-diol - CAS 98142-98-4
Catalog: |
BB042119 |
Product Name: |
2-Amino-5-methoxypyrimidine-4,6-diol |
CAS: |
98142-98-4 |
Synonyms: |
2-amino-4-hydroxy-5-methoxy-1H-pyrimidin-6-one; 2-amino-4-hydroxy-5-methoxy-1H-pyrimidin-6-one |
IUPAC Name: | 2-amino-4-hydroxy-5-methoxy-1H-pyrimidin-6-one |
Description: | 2-Amino-5-methoxypyrimidine-4,6-diol (CAS# 98142-98-4 ) is a useful research chemical. |
Molecular Weight: | 157.13 |
Molecular Formula: | C5H7N3O3 |
Canonical SMILES: | COC1=C(N=C(NC1=O)N)O |
InChI: | InChI=1S/C5H7N3O3/c1-11-2-3(9)7-5(6)8-4(2)10/h1H3,(H4,6,7,8,9,10) |
InChI Key: | BEBIJDKTTZMGDN-UHFFFAOYSA-N |
Density: | 1.73±0.1 g/cm3 (20 °C, 760 mmH g) |
LogP: | -0.35250 |
Publication Number | Title | Priority Date |
BR-112019011284-A2 | compound, pharmaceutical composition, methods of treating a condition, hbv and cancer, and, use of a compound. | 20161205 |
CN-1320122-A | Pyrazole derivatives and salts thereof | 19980724 |
EP-1103551-A1 | Pyrazole derivatives and salts thereof | 19980724 |
US-6573377-B1 | Pyrazole derivatives and salts thereof | 19980724 |
WO-0005230-A1 | Pyrazole derivatives and salts thereof | 19980724 |
Complexity: | 256 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.04874109 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.04874109 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 96.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.3 |
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