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Nuclomedone

CAT: 0013-GTR19154981-07Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19154981-07Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Nuclomedone is a biochemicals.
CAS Number
75963-52-9
Purity
>98% (HPLC)
Smiles
O=C (C1Cc (cc2) ccc2Cl) N (CCS2) C2=NC1=O
Molecular Formula
C13H11ClN2O2S
Molecular Weight
294.76
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Nuclomedone

structure given in first source

CAS Number75963-52-9
PubChem CID128798
IUPAC Name6-[(4-chlorophenyl)methyl]-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-5,7-dione
Molecular FormulaC13H11ClN2O2S
Molecular Weight294.76
XLogP2.6
Topological Polar Surface Area75
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity432
SMILES
C1CSC2=NC(=O)C(C(=O)N21)CC3=CC=C(C=C3)Cl
InChI
InChI=1S/C13H11ClN2O2S/c14-9-3-1-8(2-4-9)7-10-11(17)15-13-16(12(10)18)5-6-19-13/h1-4,10H,5-7H2
InChIKey
QSKVYHYMQQQAFS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nuclomedone
CAS: 75963-52-9
CID: 128798
Formula: C13H11ClN2O2S
MW: 294.76
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.76
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass294.0229765
Monoisotopic Mass294.0229765
Topological Polar Surface Area75 Ų
Heavy Atom Count19
Formal Charge0
Complexity432
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

Alternative Products

CatalogName
M24764-01Nuclomedone

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