Basic information
- CAS
78060-46-5- Standard SMILES
Clc1ccc2nc(N3CCNCC3)ccc2c1- InChIKey
GSFXEINORRSYJW-UHFFFAOYSA-N- Molecular formula
- C13H14ClN3
- Average molar mass
- 247.72 g/mol
- Monoisotopic mass
- 247.08762513
Names & identifiers
- Preferred name
- 6-Chloro-2-piperazin-1-yl-quinoline
- IUPAC
- 6-chloro-2-piperazin-1-ylquinoline
- English name
- 6-Chloro-2-piperazin-1-yl-quinoline
- Molecular formula
- C13H14ClN3
- Molecular weight
- 247.72
Names & synonyms
6-chloro-2-piperazin-1-yl-quinoline78060-46-5DTXSID60437575RefChem:307876DTXCID403883996-Chloro-2-(piperazin-1-yl)quinoline6-chloro-2-piperazin-1-ylquinolineMFCD041152746-chloro-2-(1-piperazinyl)quinolineCHEMBL2905376V82RS3X4YSCHEMBL4182196
Show more names
GSFXEINORRSYJW-UHFFFAOYSA-NBDBM50090216AB198476-chloranyl-2-piperazin-1-yl-quinolinePD182876Quinoline, 6-chloro-2-(1-piperazinyl)-DB-075405CS-0340070
Database identifiers
- CAS
78060-46-5- PubChem CID
- 10264015
- DTXSID
DTXSID60437575- ChEMBL
CHEMBL290537- UNII
- 6V82RS3X4Y
- Nikkaji
- J1.357.224K
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 255
Chemistry & industry
Suppliers5 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海智乾生物科技有限公司[email protected]
Related reactions
11 records
Compound notes
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