Basic information
- Standard SMILES
COCCNc1nc(-c2ccc3c(c2)c2cc(-c4ccc(Cl)cc4Cl)c(=O)n(C)c2n3C)cs1- InChIKey
XTKPMCMPKYQKQI-UHFFFAOYSA-N- Molecular formula
- C25H22Cl2N4O2S
- Average molar mass
- 513.4 g/mol
Names & identifiers
- Preferred name
- 3-(2,4-Dichlorophenyl)-6-[2-(2-methoxyethylamino)thiazol-4-yl]-1,9-dimethyl-1,9-dihydropyrido[2,3-b]indol-2-one
- IUPAC
- 3-(2,4-dichlorophenyl)-6-[2-(2-methoxyethylamino)-1,3-thiazol-4-yl]-1,9-dimethylpyrido[2,3-b]indol-2-one
Names & synonyms
SCHEMBL1338131XTKPMCMPKYQKQI-UHFFFAOYSA-N3-(2,4-Dichlorophenyl)-6-[2-(2-methoxyethylamino)thiazol-4-yl]-1,9-dimethyl-1,9-dihydropyrido[2,3-b]indol-2-one
Database identifiers
- PubChem CID
- 86623957
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 87.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 788
Related reactions
1 records
Compound notes
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