Basic information
- CAS
221292-08-6- Standard SMILES
Cl.O=[N+]([O-])c1nccn1CCCNc1ccnc2cc(Cl)ccc12- InChIKey
LWTUZIMLIKOKDI-UHFFFAOYSA-N- Molecular formula
- C15H15Cl2N5O2
- Average molar mass
- 368.2 g/mol
- Monoisotopic mass
- 367.0602801
Overview
structure in first source
Names & identifiers
- Preferred name
- 4-(3-(2-Nitro-1-imidazolyl)-propylamino)-7-chloroquinoline hydrochloride
- IUPAC
- 7-chloro-N-[3-(2-nitroimidazol-1-yl)propyl]quinolin-4-amine;hydrochloride
Names & synonyms
NLCQ-14-(3-(2-nitro-1-imidazolyl)-propylamino)-7-chloroquinoline hydrochloride4-[3-(2-nitro-1-imidazolyl)-propylamino]-7-chloroquinoline hydrochlorideRefChem:912116NLCQ-1 HCl221292-08-67-chloro-N-[3-(2-nitroimidazol-1-yl)propyl]quinolin-4-amine;hydrochlorideNSC709257NLCQ-1 hydrochlorideNLCQ1FSQ8ZG98QRNLCQ 1 [WHO-DD]
Show more names
orb1695886SCHEMBL1284999CHEMBL1922429SCHEMBL30149952SCHEMBL30149953AKOS040753293NSC-709257T33699
Database identifiers
- CAS
221292-08-6- PubChem CID
- 398939
- ChEMBL
CHEMBL1922429- UNII
- FSQ8ZG98QR
Properties
Computed structural properties
- Topological polar surface area
- 88.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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