3-Methyl-6,7-dihydropyrrolo[1,2-b:5,4-c']dipyridazine
Basic information
- CAS
14628-64-9- Standard SMILES
Cc1cc2cc3n(c2nn1)N=CCC3- InChIKey
UXOBIRRKGWWZGI-UHFFFAOYSA-N- Molecular formula
- C10H10N4
- Average molar mass
- 186.21 g/mol
- Monoisotopic mass
- 186.09054634
Names & identifiers
- Preferred name
- 3-Methyl-6,7-dihydropyrrolo[1,2-b:5,4-c']dipyridazine
- IUPAC
- 5-methyl-1,3,4,13-tetrazatricyclo[7.4.0.02,7]trideca-2(7),3,5,8,12-pentaene
Names & synonyms
14628-64-9NSC 193042NSC1930423-Methyl-6,7-dihydropyrrolo[1,2-b:5,4-c']dipyridazineDTXSID20307588NSC-193042
Database identifiers
- CAS
14628-64-9- PubChem CID
- 303675
- DTXSID
DTXSID20307588
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 253
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Compound notes
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