Basic information
- Standard SMILES
Cc1cccc(-c2nn3c(c2-c2ccnc4cc(CCC(=O)N(C)C)ccc24)CCC3)n1- InChIKey
IRVNKTNPMXCCJF-UHFFFAOYSA-N- Molecular formula
- C26H27N5O
- Average molar mass
- 425.5 g/mol
Names & identifiers
- Preferred name
- N,N-Dimethyl-3-{4-[2-(6-methyl-pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-quinolin-7-yl}-propionamide
- IUPAC
- N,N-dimethyl-3-[4-[2-(6-methyl-2-pyridinyl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinolin-7-yl]propanamide
Names & synonyms
SCHEMBL5236124IRVNKTNPMXCCJF-UHFFFAOYSA-NN,N-Dimethyl-3-{4-[2-(6-methyl-pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]-quinolin-7-yl}-propionamide
Database identifiers
- PubChem CID
- 10274004
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 656
Experimental & physicochemical properties
Exact Mass425.22156050 Da
Molecular Weight425.5 g/mol
Monoisotopic Mass425.22156050 Da
Compound Is CanonicalizedYes
Related reactions
2 records
Compound notes
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