Basic information
- Standard SMILES
COc1cc2c(cc1Oc1ccnc(C(=O)NCCN3CCCC3)c1)nc(Nc1ccc(Cl)cc1)n2C- InChIKey
UDCANSUZQGMJLP-UHFFFAOYSA-N- Molecular formula
- C27H29ClN6O3
- Average molar mass
- 521 g/mol
- Monoisotopic mass
- 520.1989665
Names & identifiers
- Preferred name
- [4-(2-{[4-Chlorophenyl]amino}-6-methoxy-1-methylbenzimidazol-5-yloxy)(2-pyridyl)]-n-(2-pyrrolidinylethyl)carboxamide
- IUPAC
- 4-[2-(4-chloroanilino)-6-methoxy-1-methylbenzimidazol-5-yl]oxy-N-(2-pyrrolidin-1-ylethyl)pyridine-2-carboxamide
Names & synonyms
SCHEMBL2889984UDCANSUZQGMJLP-UHFFFAOYSA-N[4-(2-{[4-chlorophenyl]amino}-6-methoxy-1-methylbenzimidazol-5-yloxy)(2-pyridyl)]-n-(2-pyrrolidinylethyl)carboxamide
Database identifiers
- PubChem CID
- 22041320
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 93.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 735
Related reactions
1 records
Compound notes
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