Products for Research Use Only

ML 297

CAT: 0127-BUP10369-06Size: 200 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BUP10369-06Size:200 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1443246-62-5
Synonyms
ML297
Purity
=95%
Smiles
Cc1cc(NC(=O)Nc2ccc(F)c(F)c2)n(n1)-c1ccccc1

Chemical Information

ML297

ML297 is an organic molecular entity. It has a role as a potassium channel opener.

CAS Number1443246-62-5
PubChem CID56642816
IUPAC Name1-(3,4-difluorophenyl)-3-(5-methyl-2-phenylpyrazol-3-yl)urea
Molecular FormulaC17H14F2N4O
Molecular Weight328.32
XLogP3.4
Topological Polar Surface Area59
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count24
Formal Charge0
Complexity433
SMILES
CC1=NN(C(=C1)NC(=O)NC2=CC(=C(C=C2)F)F)C3=CC=CC=C3
InChI
InChI=1S/C17H14F2N4O/c1-11-9-16(23(22-11)13-5-3-2-4-6-13)21-17(24)20-12-7-8-14(18)15(19)10-12/h2-10H,1H3,(H2,20,21,24)
InChIKey
IEKSMUSSYJUQMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of ML297
CAS: 1443246-62-5
CID: 56642816
Formula: C17H14F2N4O
MW: 328.32
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight328.32
XLogP33.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass328.11356741
Monoisotopic Mass328.11356741
Topological Polar Surface Area59 Ų
Heavy Atom Count24
Formal Charge0
Complexity433
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