8009-7184 Screening compound: 6-benzyl-2-sulfanyl-4-pyrimidinol
Chemical Structure Depiction of ChemDiv screening compound 8009-7184
6-benzyl-2-sulfanyl-4-pyrimidinol
Available from 1 mg
Formats:
- Glass Vials (4ml Glass Vials VWR #97047-678)
- 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)
Shiptime: 1 week worldwide delivery in most cases
Compound Identifiers
ChemDiv Compound ID
8009-7184
Molecular Formula
C11H10N2OS (C11 H10 N2 OS)
Compound Name
6-benzyl-2-sulfanyl-4-pyrimidinol
IUPAC name
6-benzyl-2-sulfanylpyrimidin-4-ol
SMILES
Oc1cc(Cc2ccccc2)nc(S)n1
InChI Key
MDL Number (MFCD)
Chemical and Physical Properties
Saltdata
n/a
Molecular Weight
218.28
Hydrogen Bond Acceptors Count
4.00
Hydrogen Bond Donors Count
2.00
Rotatable Bond Count
2.00
Number of Nitrogen and Oxygen Atoms
3
Partition Coefficient, logP
2.319
Distribution Coefficient, logD
1.181
Water Solubility, LogSw
-2.09
Polar Surface Area
33.891
Acid Dissociation Constant (pKa)
6.29
Base Dissociation Constant (pKb)
-2.55
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
9.09
8009-7184 in Drug Discovery
Included in Screening Libraries
300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)
Carbonic Anhydrase II Library (4939 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Included in 1.7M Stock Database
References: we are preparing a list of scientific research reports with 8009-7184 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)