N~2~-(3-Benzoyl-1,5-naphthyridin-4(1H)-ylidene)-N-(4-chlorophenyl)-N-methylalaninamide
Basic information
- CAS
127447-89-6- Standard SMILES
CC(Nc1c(C(=O)c2ccccc2)cnc2cccnc12)C(=O)N(C)c1ccc(Cl)cc1- InChIKey
ZGZILBIRQVKWGL-UHFFFAOYSA-N- Molecular formula
- C25H21ClN4O2
- Average molar mass
- 444.9 g/mol
- Monoisotopic mass
- 444.1353036
Names & identifiers
- Preferred name
- N~2~-(3-Benzoyl-1,5-naphthyridin-4(1H)-ylidene)-N-(4-chlorophenyl)-N-methylalaninamide
- IUPAC
- 2-[(3-benzoyl-1,5-naphthyridin-4-yl)amino]-N-(4-chlorophenyl)-N-methylpropanamide
Names & synonyms
127447-89-6DTXSID30925893N~2~-(3-Benzoyl-1,5-naphthyridin-4(1H)-ylidene)-N-(4-chlorophenyl)-N-methylalaninamideRefChem:1093447DTXCID101354716SR 26455(+-)-2-((3-Benzoyl-1,5-naphthyridin-4-yl)amino)-N-(4-chlorophenyl)-N-methylpropanamidePropanamide, 2-((3-benzoyl-1,5-naphthyridin-4-yl)amino)-N-(4-chlorophenyl)-N-methyl-, (+-)-
Database identifiers
- CAS
127447-89-6- PubChem CID
- 3080179
- DTXSID
DTXSID30925893
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 648
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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