Basic information
- CAS
282536-25-8- Standard SMILES
Cn1cc(C(=O)NCc2ccc(Cl)cc2)c(=O)c2cc(CN3CCOCC3)ccc21- InChIKey
SXLQSQMKOYVAAW-UHFFFAOYSA-N- Molecular formula
- C23H24ClN3O3
- Average molar mass
- 425.9 g/mol
Overview
structure in first source
Names & identifiers
- Preferred name
- Pnu-183792
- IUPAC
- N-[(4-chlorophenyl)methyl]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxoquinoline-3-carboxamide
Names & synonyms
PNU-183792Pnu183792282536-25-8PHA-183792X9ARA56MXBRefChem:202661PNU 183792UNII-X9ARA56MXBCHEMBL194433N-(4-chlorobenzyl)-1-methyl-6-(morpholinomethyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide3-Quinolinecarboxamide, N-((4-chlorophenyl)methyl)-1,4-dihydro-1-methyl-6-(4-morpholinylmethyl)-4-oxo-N-((4-Chlorophenyl)methyl)-1,4-dihydro-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-quinolinecarboxamide
Show more names
3-Quinolinecarboxamide, N-[(4-chlorophenyl)methyl]-1,4-dihydro-1-methyl-6-(4-morpholinylmethyl)-4-oxo-orb3135508SCHEMBL6699690SCHEMBL30372497SXLQSQMKOYVAAW-UHFFFAOYSA-NBDBM50172526N-[(4-chlorophenyl)methyl]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxoquinoline-3-carboxamideN-[(4-chlorophenyl)methyl]-1-methyl-6-[(morpholin-4-yl)methyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Database identifiers
- CAS
282536-25-8- PubChem CID
- 492406
- ChEMBL
CHEMBL194433- UNII
- X9ARA56MXB
- Nikkaji
- J1.707.614K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 61.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 656
Related reactions
2 records
Compound notes
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