CELIPROLOL HYDROCHLORIDE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: G1M3398594

Structure
InChI Key VKJHTUVLJYWAEY-UHFFFAOYSA-N
Smile CCN(CC)C(=O)Nc1ccc(OCC(O)CNC(C)(C)C)c(C(C)=O)c1.Cl
InChI
InChI=1S/C20H33N3O4.ClH/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6;/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26);1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H34ClN3O4
Molecular Weight 415.96
AlogP 2.89
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 9.0
Polar Surface Area 90.9
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 27.0

Cross References

Resources Reference
ChEBI 31385
ChEMBL CHEMBL1742424
EPA CompTox DTXSID0046850
FDA SRS G1M3398594
PubChem 42373
SureChEMBL SCHEMBL349227
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