AMBUTONIUM BROMIDE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 9J8YA3ZT14

Structure
InChI Key VTAGVKVPFBOVRM-UHFFFAOYSA-N
Smile CC[N+](C)(C)CCC(C(N)=O)(c1ccccc1)c1ccccc1.[Br-]
InChI
InChI=1S/C20H26N2O.BrH/c1-4-22(2,3)16-15-20(19(21)23,17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5-14H,4,15-16H2,1-3H3,(H-,21,23);1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H27BrN2O
Molecular Weight 391.35
AlogP 2.94
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 7.0
Polar Surface Area 43.09
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 23.0

Cross References

Resources Reference
ChEMBL CHEMBL2105972
FDA SRS 9J8YA3ZT14
PubChem 8276
SureChEMBL SCHEMBL249674
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