2-Amino-7-chloro-3H-quinazolin-4-one - CAS 20198-18-9
Catalog: |
BB042538 |
Product Name: |
2-Amino-7-chloro-3H-quinazolin-4-one |
CAS: |
20198-18-9 |
Synonyms: |
2-Amino-7-chloroquinazolin-4-ol; 2-Amino-7-chloro-3,4-dihydroquinazolin-4-one |
IUPAC Name: | 2-amino-7-chloro-3H-quinazolin-4-one |
Description: | 2-Amino-7-chloro-3H-quinazolin-4-one (CAS# 20198-18-9 ) is a useful research chemical. |
Molecular Weight: | 195.60 |
Molecular Formula: | C8H6ClN3O |
Canonical SMILES: | C1=CC2=C(C=C1Cl)N=C(NC2=O)N |
InChI: | InChI=1S/C8H6ClN3O/c9-4-1-2-5-6(3-4)11-8(10)12-7(5)13/h1-3H,(H3,10,11,12,13) |
InChI Key: | AYQNXSWNEYAFSB-UHFFFAOYSA-N |
Complexity: | 266 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.0199395 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.0199395 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 67.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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