6H-Pyridazino(4,5-b)carbazole, 1,4-diethoxy-5-ethyl-
Basic information
- CAS
126854-09-9- Standard SMILES
CCOc1n[nH]c(OCC)c2c(CC)c3nc4ccccc4c3cc12- InChIKey
KDSSQNNNMDFRSS-UHFFFAOYSA-N- Molecular formula
- C20H21N3O2
- Average molar mass
- 335.4 g/mol
- Monoisotopic mass
- 335.16337692
Names & identifiers
- Preferred name
- 6H-Pyridazino(4,5-b)carbazole, 1,4-diethoxy-5-ethyl-
- IUPAC
- 1,4-diethoxy-5-ethyl-3H-pyridazino[4,5-b]carbazole
Names & synonyms
BRN 59948086H-Pyridazino(4,5-b)carbazole, 1,4-diethoxy-5-ethyl-126854-09-91,4-diethoxy-5-ethyl-6H-pyridazino[4,5-b]carbazole1,4-Diethoxy-5-ethyl-6H-pyridazino(4,5-b)carbazoleDiethoxy-1,4 ethyl-5 6H-pyridazino(4,5-b)carbazoleDTXSID30155310
Database identifiers
- CAS
126854-09-9- PubChem CID
- 3080004
- DTXSID
DTXSID30155310- Nikkaji
- J240.021I
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 55.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 877
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Compound notes
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