Products for Research Use Only
RegisterLogin

DR2313

CAT: 0127-BUP06349-02Size: 10 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-BUP06349-02Size:10 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
284028-90-6
Synonyms
DR 2313
Purity
=98%
Smiles
Cc1nc(=O)c2CSCCc2[nH]1

Chemical Information

2-Methyl-3,5,7,8-tetrahydrothiopyrano(4,3-d)pyrimidine-4-one

a neuroprotective agent; structure in first source

CAS Number284028-90-6
PubChem CID135522417
IUPAC Name2-methyl-3,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one
Molecular FormulaC8H10N2OS
Molecular Weight182.25
XLogP-0.2
Topological Polar Surface Area66.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity293
SMILES
CC1=NC2=C(CSCC2)C(=O)N1
InChI
InChI=1S/C8H10N2OS/c1-5-9-7-2-3-12-4-6(7)8(11)10-5/h2-4H2,1H3,(H,9,10,11)
InChIKey
HRYKZAKEAVZGJD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methyl-3,5,7,8-tetrahydrothiopyrano(4,3-d)pyrimidine-4-one
CAS: 284028-90-6
CID: 135522417
Formula: C8H10N2OS
MW: 182.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight182.25
XLogP3-0.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass182.05138412
Monoisotopic Mass182.05138412
Topological Polar Surface Area66.8 Ų
Heavy Atom Count12
Formal Charge0
Complexity293
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

Alternative Products

CatalogName
1771-5DR2313
sc-202756PARP Inhibitor XI, DR2313

Popular Products