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Iclaprim

CAT: 1596-AR-I01123-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-I01123-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
192314-93-5
Synonyms
5- ((2-cyclopropyl-7,8-dimethoxy-2H-chromen-5-yl) methyl) pyrimidine-2,4-diamine; 5-[ (2-Cyclopropyl-7,8-dimethoxy-2H-1-benzopyran-5-yl) methyl]-2,4-pyrimidine-diamine; AR 100
Molecular Formula
C19H22N4O3
Molecular Weight
354.41
API Name
Iclaprim

Chemical Information

Iclaprim

5-[(2-cyclopropyl-7,8-dimethoxy-2H-chromen-5-yl)methyl]pyrimidine-2,4-diamine is an aminopyrimidine that is 5-methylpyrimidine-2,4-diamine in which one of the hydrogens of the methyl group has been replaced by a 2-cyclopropyl-7,8-dimethoxy-2H-chromen-5-yl group. It is a member of chromenes, an aminopyrimidine and a member of cyclopropanes.

CAS Number192314-93-5
PubChem CID213043
IUPAC Name5-[(2-cyclopropyl-7,8-dimethoxy-2H-chromen-5-yl)methyl]pyrimidine-2,4-diamine
Molecular FormulaC19H22N4O3
Molecular Weight354.4
XLogP2.5
Topological Polar Surface Area106
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity515
SMILES
COC1=C(C2=C(C=CC(O2)C3CC3)C(=C1)CC4=CN=C(N=C4N)N)OC
InChI
InChI=1S/C19H22N4O3/c1-24-15-8-11(7-12-9-22-19(21)23-18(12)20)13-5-6-14(10-3-4-10)26-16(13)17(15)25-2/h5-6,8-10,14H,3-4,7H2,1-2H3,(H4,20,21,22,23)
InChIKey
HWJPWWYTGBZDEG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Iclaprim
CAS: 192314-93-5
CID: 213043
Formula: C19H22N4O3
MW: 354.4
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight354.4
XLogP32.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass354.16919058
Monoisotopic Mass354.16919058
Topological Polar Surface Area106 Ų
Heavy Atom Count26
Formal Charge0
Complexity515
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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A20367-50Iclaprim 50mg

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