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Buflomedil

CAT: 1596-AR-B02197-06Size: 250 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-B02197-06Size:250 Units
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CAS Number
55837-25-7
Synonyms
4- (pyrrolidin-1-yl) -1- (2,4,6-trimethoxyphenyl) butan-1-one; 4- (1-Pyrrolidinyl) -1- (2,4,6-trimethoxyphenyl) -1-butanone; Bufedil; Buflan; Buflocit; Buflonat; Fonzylane; Irrodan; Irrodan R; LL 1656; Lofton; Loftyl; Provas
Molecular Formula
C17H25NO4
Molecular Weight
307.39
API Name
Buflomedil

Chemical Information

Buflomedil

4-(1-pyrrolidinyl)-1-(2,4,6-trimethoxyphenyl)-1-butanone is an aromatic ketone.

CAS Number55837-25-7
PubChem CID2467
IUPAC Name4-pyrrolidin-1-yl-1-(2,4,6-trimethoxyphenyl)butan-1-one
Molecular FormulaC17H25NO4
Molecular Weight307.4
XLogP2.3
Topological Polar Surface Area48
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count22
Formal Charge0
Complexity330
SMILES
COC1=CC(=C(C(=C1)OC)C(=O)CCCN2CCCC2)OC
InChI
InChI=1S/C17H25NO4/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18/h11-12H,4-10H2,1-3H3
InChIKey
OWYLAEYXIQKAOL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Buflomedil
CAS: 55837-25-7
CID: 2467
Formula: C17H25NO4
MW: 307.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight307.4
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass307.17835828
Monoisotopic Mass307.17835828
Topological Polar Surface Area48 Ų
Heavy Atom Count22
Formal Charge0
Complexity330
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes