6-Chloro-4-phenylquinazoline - CAS 4015-28-5
Catalog: |
BB062402 |
Product Name: |
6-Chloro-4-phenylquinazoline |
CAS: |
4015-28-5 |
Synonyms: |
6-chloro-4-phenylquinazoline; 4-Phenyl-6-chloroquinazoline; 6-Chloro-4-phenyl-quinazoline; Quinazoline-6-chloro-4-phenyl-; Quinazoline, 6-chloro-4-phenyl- |
IUPAC Name: | 6-chloro-4-phenylquinazoline |
Molecular Weight: | 240.69 |
Molecular Formula: | C14H9ClN2 |
Canonical SMILES: | C1=CC=C(C=C1)C2=NC=NC3=C2C=C(C=C3)Cl |
InChI: | InChI=1S/C14H9ClN2/c15-11-6-7-13-12(8-11)14(17-9-16-13)10-4-2-1-3-5-10/h1-9H |
InChI Key: | PDVBMNDBLYNSIS-UHFFFAOYSA-N |
Complexity: | 253 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.045426 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.045426 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 25.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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