Nelezaprine

Base Information

• Chemical Name: Nelezaprine
• CAS No.: 69624-60-8
• Molecular Formula: C18H21ClN2
• Molecular Weight: 300.831
• UNII: OC19J8O751
• Wikidata: Q27285558
• NCI Thesaurus Code: C90893
• ChEMBL ID: CHEMBL2110942
• Mol file: 69624-60-8.mol

Synonyms:Nelezaprine;Nelezaprine [INN];UNII-OC19J8O751;OC19J8O751;69624-60-8;CHEMBL2110942;SCHEMBL11649090;SCHEMBL11649093;Q27285558;(E)-9-CHLORO-11-(3-(DIMETHYLAMINO)PROPYLIDENE)-6,11-DIHYDRO-5H-PYRROLO(2,1-B)(3)BENZAZEPINE;1-PROPANAMINE, 3-(9-CHLORO-5,6-DIHYDRO-11H-PYRROLO(2,1-B)(3)BENZAZEPIN-11-YLIDENE)-N,N-DIMETHYL-, (E)-, (Z)-2-

Chemical Property of Nelezaprine

Chemical Property:

• PSA: 8.17000
• LogP: 4.08100
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 300.1393264
• Heavy Atom Count: 21
• Complexity: 379

Purity/Quality:

NELEZAPRINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)CCC=C1C2=CC=CN2CCC3=C1C=C(C=C3)Cl
• Isomeric SMILES: CN(C)CC/C=C\1/C2=CC=CN2CCC3=C1C=C(C=C3)Cl