Products for Research Use Only
RegisterLogin

Compound EN300-214796

CAT: 0931-TPL0561-01Size: 500 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TPL0561-01Size:500 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
28648-87-5
Bioactivity
Compound EN300-214796, with CAS No. 28648-87-5, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound EN300-214796 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
Smiles
N1C=C(C=N1)C1=CC=NC=N1
Molecular Formula
C7H6N4
Molecular Weight
146.153
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-(1H-pyrazol-4-yl)pyrimidine
CAS Number28648-87-5
PubChem CID5073229
IUPAC Name4-(1H-pyrazol-4-yl)pyrimidine
Molecular FormulaC7H6N4
Molecular Weight146.15
XLogP0.2
Topological Polar Surface Area54.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity128
SMILES
C1=CN=CN=C1C2=CNN=C2
InChI
InChI=1S/C7H6N4/c1-2-8-5-9-7(1)6-3-10-11-4-6/h1-5H,(H,10,11)
InChIKey
XHWTWNCQBNQUDK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(1H-pyrazol-4-yl)pyrimidine
CAS: 28648-87-5
CID: 5073229
Formula: C7H6N4
MW: 146.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight146.15
XLogP30.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass146.059246208
Monoisotopic Mass146.059246208
Topological Polar Surface Area54.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity128
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

Related Products

CatalogName
TPL0628-01Compound EN300-86475
TPL0605-01Compound EN300-338553
TPL0598-01Compound EN300-21809
TPL0585-01Compound EN300-221999
TPL0560-01Compound EN300-102393
TPL0556-01Compound EN300-258458
TPL0552-01Compound EN300-00180
TPL0549-01Compound EN300-75552
TPL0545-01Compound EN300-203973
TPL0531-01Compound EN300-25537

Alternative Products

CatalogName
GTR19280022-01Compound EN300-88285
GTR19280020-01Compound EN300-06260
GTR19280017-01Compound EN300-24646
GTR19280015-01Compound EN300-62851
GTR19270227-01Compound EN300-24520
GTR19270223-01Compound EN300-113927
GTR19270222-01Compound EN300-219925
GTR19270221-01Compound EN300-365455
GTR19270233-01Compound EN300-1724756
GTR19280023-01Compound EN300-121824

Popular Products