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Trimethoprim hydrochloride

CAT: 0013-GTR19220537-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19220537-01Size:50 mg
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Description
Trimethoprim hydrochloride is a bacteriostatic antibiotic that inhibits dihydrofolate reductase, effective against various Gram-positive and Gram-negative bacteria. It is used in research models of urinary tract infections, Shigellosis, and Pneumocystis pneumonia, and, in combination with zinc, has shown antiviral activity against Influenza A in chick embryo studies.
CAS Number
60834-30-2
Field of Research
Cell Biology, Infectious Disease & Virology, Pharmacology & Drug Discovery
Smiles
C (C1=CC (OC) =C (OC) C (OC) =C1) C=2C (N) =NC (N) =NC2.Cl
Molecular Formula
C14H19ClN4O3
Molecular Weight
326.78
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Trimethoprim Hydrochloride

See also: Trimethoprim (has active moiety); Sulfamethoxazole-trimethoprim mixt. (annotation moved to).

CAS Number60834-30-2
PubChem CID173769
IUPAC Name5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine;hydrochloride
Molecular FormulaC14H19ClN4O3
Molecular Weight326.78
Topological Polar Surface Area106
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity307
SMILES
COC1=CC(=CC(=C1OC)OC)CC2=CN=C(N=C2N)N.Cl
InChI
InChI=1S/C14H18N4O3.ClH/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;/h5-7H,4H2,1-3H3,(H4,15,16,17,18);1H
InChIKey
YLCCEQZHUHUYPA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Trimethoprim Hydrochloride
CAS: 60834-30-2
CID: 173769
Formula: C14H19ClN4O3
MW: 326.78
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.78
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass326.1145682
Monoisotopic Mass326.1145682
Topological Polar Surface Area106 Ų
Heavy Atom Count22
Formal Charge0
Complexity307
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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