Basic information
- Standard SMILES
COc1ccc(NC(=O)c2cccc(C(C)(C)C#N)c2)cc1Oc1ccc2nc(NC(=O)C3CC3)cn2n1- InChIKey
ZUCWJZDOVOOGSB-UHFFFAOYSA-N- Molecular formula
- C28H26N6O4
- Average molar mass
- 510.5 g/mol
- Monoisotopic mass
- 510.20155333
Names & identifiers
- Preferred name
- 3-(1-cyano-1-methylethyl)-N-[3-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-b]pyridazin-6-yl}oxy)-4-methoxyphenyl]benzamide
- IUPAC
- 3-(2-cyanopropan-2-yl)-N-[3-[2-(cyclopropanecarbonylamino)imidazo[1,2-b]pyridazin-6-yl]oxy-4-methoxyphenyl]benzamide
Names & synonyms
SCHEMBL2520653ZUCWJZDOVOOGSB-UHFFFAOYSA-N3-(1-cyano-1-methylethyl)-N-[3-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-b]pyridazin-6-yl}oxy)-4-methoxyphenyl]benzamide
Database identifiers
- PubChem CID
- 57505697
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 916
Related reactions
4 records
Compound notes
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