3-Amino-6-chloro-3,4-dihydro-2(1H)-quinazolinone - CAS 183054-18-4
Catalog: |
BB061208 |
Product Name: |
3-Amino-6-chloro-3,4-dihydro-2(1H)-quinazolinone |
CAS: |
183054-18-4 |
Synonyms: |
3-Amino-6-chloro-3,4-dihydroquinazolin-2(1H)-one; 3-amino-6-chloro-1,4-dihydroquinazolin-2-one |
IUPAC Name: | 3-amino-6-chloro-1,4-dihydroquinazolin-2-one |
Molecular Weight: | 197.62 |
Molecular Formula: | C8H8ClN3O |
Canonical SMILES: | C1C2=C(C=CC(=C2)Cl)NC(=O)N1N |
InChI: | InChI=1S/C8H8ClN3O/c9-6-1-2-7-5(3-6)4-12(10)8(13)11-7/h1-3H,4,10H2,(H,11,13) |
InChI Key: | UXRSRUSCRWVTFT-UHFFFAOYSA-N |
Complexity: | 223 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 197.0355896 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 197.0355896 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 58.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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