Products for Research Use Only
RegisterLogin

GR-95168

CAT: 0931-T67800-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T67800-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
95463-56-2
Target
Antifection
Related Pathways
Microbiology/Virology
Purity
>99.99%
Bioactivity
GR-95168 ((+) -C-BVDU) is an antiviral compound for the study of herpes simplex virus infections type 1 and type 2.
Smiles
O=C1N([C@@H]2C[C@H](CO)[C@@H](O)C2)C=C(/C=C/Br)C(=O)N1
Molecular Formula
C12H15BrN2O4
Molecular Weight
331.16
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-[(E)-2-bromoethenyl]-1-[(1R,3S,4R)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
CAS Number95463-56-2
PubChem CID6479188
IUPAC Name5-[(E)-2-bromoethenyl]-1-[(1R,3S,4R)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
Molecular FormulaC12H15BrN2O4
Molecular Weight331.16
XLogP0.4
Topological Polar Surface Area89.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity449
SMILES
C1[C@H](C[C@@H]([C@H]1CO)O)N2C=C(C(=O)NC2=O)/C=C/Br
InChI
InChI=1S/C12H15BrN2O4/c13-2-1-7-5-15(12(19)14-11(7)18)9-3-8(6-16)10(17)4-9/h1-2,5,8-10,16-17H,3-4,6H2,(H,14,18,19)/b2-1+/t8-,9-,10+/m1/s1
InChIKey
KAVDAMFOTJIBCK-CTNBOOGPSA-N
Chemical Structure
2D Structure
2D structure of 5-[(E)-2-bromoethenyl]-1-[(1R,3S,4R)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
CAS: 95463-56-2
CID: 6479188
Formula: C12H15BrN2O4
MW: 331.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight331.16
XLogP30.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass330.02152
Monoisotopic Mass330.02152
Topological Polar Surface Area89.9 Ų
Heavy Atom Count19
Formal Charge0
Complexity449
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
T9901A-1689-01GR-1405
T70633-01GR-92549
T209926-01GR-28
T31990GR 63799
T25459-01GR 100679
T22811-01GR 94800
T15414-01GR 113808
T71071-01GR-71251
T15415-01GR 159897
T22808-01GR 46611

Alternative Products

CatalogName
MBS5810383GR-95168
317880-01GR
70R-31293GR antibody
EFA62301-01GR 82334
MFA59352-01GR 64349
UFA62551-01GR 113808
TRC-G779535-25MGGR 89696
HY-120840GR 100679
HY-120182GR 128107
343644-01GR discontinued

Popular Products