2-(Propan-2-yl)-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one - CAS 1376278-48-6
Catalog: |
BB072706 |
Product Name: |
2-(Propan-2-yl)-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one |
CAS: |
1376278-48-6 |
Synonyms: |
2-(propan-2-yl)-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one; 2-Isopropyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3(2H)-one; 2-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one |
IUPAC Name: | 2-propan-2-yl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one |
Molecular Weight: | 193.24 |
Molecular Formula: | C10H15N3O |
Canonical SMILES: | CC(C)N1C(=O)C=C2CNCCC2=N1 |
InChI: | InChI=1S/C10H15N3O/c1-7(2)13-10(14)5-8-6-11-4-3-9(8)12-13/h5,7,11H,3-4,6H2,1-2H3 |
InChI Key: | UDXBSHHCONFBBW-UHFFFAOYSA-N |
Complexity: | 317 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 193.12151211 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 193.12151211 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 44.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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