JP1302
Completing data — refresh the page later to see the latest
Basic information
- CAS
80259-18-3- Standard SMILES
CN1CCN(c2ccc(Nc3c4ccccc4nc4ccccc34)cc2)CC1- InChIKey
QZKGUNQLVFEEBA-UHFFFAOYSA-N- Molecular formula
- C24H24N4
- Average molar mass
- 368.5 g/mol
- Monoisotopic mass
- 368.20009678
Overview
alpha2C-adrenoceptor antagonist, may have therapeutic potential for treatment of neuropsychiatric disorders; structure in first source
Names & identifiers
- Preferred name
- JP1302
- IUPAC
- N-[4-(4-methylpiperazin-1-yl)phenyl]acridin-9-amine
- English name
- JP1302
- Molecular formula
- C24H24N4
- Molecular weight
- 368.47
Names & synonyms
JP1302N-[4-(4-methylpiperazin-1-yl)phenyl]acridin-9-amineN-(4-(4-methylpiperazin-1-yl)phenyl)acridin-9-amineJP-1302RefChem:92397480259-18-3N-(4-(4-Methyl-1-piperazinyl)phenyl)-9-acridinamineJP 1302GNF-PF-3427TCMDC-123912MMV006172CHEMBL106525
Show more names
(R)-Carvedilol-dJP 1302 dihydrochlorideJP1302(9-Acridinamine, N-[4-(4-methyl-1-piperazinyl)phenyl]-)N-[4-(4-Methyl-1-piperazinyl)phenyl]-9-acridinaminedihydrochloride
9-Acridinamine, N-(4-(4-methyl-1-piperazinyl)phenyl)-N-[4-(4-Methyl-1-piperazinyl)phenyl]-9-acridinamineAcridin-9-yl-[4-(4-methyl-piperazin-1-yl)-phenyl]-amineBRN 5117597MFCD105655999-Acridinamine, N-[4-(4-methyl-1-piperazinyl)phenyl]-CBDivE_004989GTPL3930
Database identifiers
- CAS
80259-18-3- PubChem CID
- 540335
- DTXSID
DTXSID70230190- ChEMBL
CHEMBL106525- Nikkaji
- J2.076.661A
Properties
Computed structural propertiesFilling in
- XLogP
- 5
- Topological polar surface area
- 31.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 473
Physicochemical properties
- Boiling point
- 550.9 · 550.9±50.0 °C(Predicted)
- Density
- 1.227 · 1.227±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Desiccate at -20°C
- pka
- 9.03 · 9.03±0.10(Predicted)
- Water Solubility
- 44.14 mg/ml · <44.14mg/ml in Water
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Applications
UsesJP 1302 Dihydrochloride is an α2-adrenoceptor blocker and can be used for the treatment or prevention of nephropathy.
Related reactions
2 records
Compound notes
Loading…