4-[(2,4-Dichloro-5-methoxyphenyl)amino]-6-methoxy-7-propoxy-3-quinolinecarbonitrile
Basic information
- CAS
2095306-25-3- Standard SMILES
CCCOc1cc2ncc(C#N)c(Nc3cc(OC)c(Cl)cc3Cl)c2cc1OC- InChIKey
NMUIBWPPWJXLIX-UHFFFAOYSA-N- Molecular formula
- C21H19Cl2N3O3
- Average molar mass
- 432.3 g/mol
- Monoisotopic mass
- 431.0803469
Names & identifiers
- Preferred name
- 4-[(2,4-Dichloro-5-methoxyphenyl)amino]-6-methoxy-7-propoxy-3-quinolinecarbonitrile
- IUPAC
- 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-propoxyquinoline-3-carbonitrile
Names & synonyms
2095306-25-34-[(2,4-Dichloro-5-methoxyphenyl)amino]-6-methoxy-7-propoxy-3-quinolinecarbonitrileGYC3C7GYC23-Quinolinecarbonitrile, 4-[(2,4-dichloro-5-methoxyphenyl)amino]-6-methoxy-7-propoxy-
Database identifiers
- CAS
2095306-25-3- PubChem CID
- 166177232
- UNII
- GYC3C7GYC2
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 575
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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