1-(3-Bromo-6-methylquinolin-4-yl)pyrrolidine-2,5-dione - CAS 1393442-63-1
Catalog: |
BB055384 |
Product Name: |
1-(3-Bromo-6-methylquinolin-4-yl)pyrrolidine-2,5-dione |
CAS: |
1393442-63-1 |
Synonyms: |
1-(3-Bromo-6-methylquinolin-4-yl)pyrrolidine-2,5-dione |
IUPAC Name: | 1-(3-bromo-6-methylquinolin-4-yl)pyrrolidine-2,5-dione |
Description: | 1-(3-Bromo-6-methylquinolin-4-yl)pyrrolidine-2,5-dione |
Molecular Weight: | 319.15 |
Molecular Formula: | C14H11BrN2O2 |
Canonical SMILES: | CC1=CC2=C(C(=CN=C2C=C1)Br)N3C(=O)CCC3=O |
InChI: | InChI=1S/C14H11BrN2O2/c1-8-2-3-11-9(6-8)14(10(15)7-16-11)17-12(18)4-5-13(17)19/h2-3,6-7H,4-5H2,1H3 |
InChI Key: | ROGYFABCFOQFSB-UHFFFAOYSA-N |
Complexity: | 385 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 318.00039 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 318.00039 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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