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1391052-71-3
Catalog No.:AA01CBDP

1391052-71-3 | 3-Des[2-(Dimethylamino)ethyl] Zolmitriptan 3-Acetic Acid Methyl Ester

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Technical Information
Catalog Number:
AA01CBDP
Chemical Name:
3-Des[2-(Dimethylamino)ethyl] Zolmitriptan 3-Acetic Acid Methyl Ester
CAS Number:
1391052-71-3
Molecular Formula:
C15H16N2O4
Molecular Weight:
288.2985
SMILES:
COC(=O)Cc1c[nH]c2c1cc(C[C@H]1COC(=N1)O)cc2
Properties
Computed Properties
 
Complexity:
415  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
5  
XLogP3:
1.7  

Literature
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SDS
Tags:1391052-71-3 Molecular Formula|1391052-71-3 MDL|1391052-71-3 SMILES|1391052-71-3 3-Des[2-(Dimethylamino)ethyl] Zolmitriptan 3-Acetic Acid Methyl Ester