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1977-08-8,MFCD01730996
Catalog No.:AA00ATBV

1977-08-8 | 2-chloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine

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  • Technical Information
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Technical Information
Catalog Number:
AA00ATBV
Chemical Name:
2-chloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine
CAS Number:
1977-08-8
Molecular Formula:
C18H19ClN4
Molecular Weight:
326.8233
MDL Number:
MFCD01730996
SMILES:
CN1CCN(CC1)C2=NC3=CC=CC=C3NC4=C2C=C(C=C4)Cl
Properties
Computed Properties
 
Complexity:
446  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.1  

Literature

Title: Pyrrolo[1,3]benzothiazepine-based serotonin and dopamine receptor antagonists. Molecular modeling, further structure-activity relationship studies, and identification of novel atypical antipsychotic agents.

Journal: Journal of medicinal chemistry 20040101

Title: The role of alpha2-adrenoceptor antagonism in the anti-cataleptic properties of the atypical neuroleptic agent, clozapine, in the rat.

Journal: British journal of pharmacology 19980801

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Tags:1977-08-8 Molecular Formula|1977-08-8 MDL|1977-08-8 SMILES|1977-08-8 2-chloro-11-(4-methyl-1-piperazinyl)-5H-dibenzo(b,e)(1,4)diazepine