F407-0463 Screening compound: 6-(3-methoxyphenyl)-2-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)pyrimidin-4-ol

F407-0463 Screening compound: 6-(3-methoxyphenyl)-2-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)pyrimidin-4-ol
F407-0463 Screening compound: 6-(3-methoxyphenyl)-2-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)pyrimidin-4-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound F407-0463
6-(3-methoxyphenyl)-2-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)pyrimidin-4-ol

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

F407-0463

Molecular Formula

C23H21N3O3S (C23 H21 N3 O3 S)

Compound Name

6-(3-methoxyphenyl)-2-({[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl}sulfanyl)pyrimidin-4-ol

IUPAC name

6-(3-methoxyphenyl)-2-({[5-methyl-2-(3-methylphenyl)-13-oxazol-4-yl]methyl}sulfanyl)pyrimidin-4-ol

SMILES

Cc1c(CSc2nc(O)cc(-c3cc(OC)ccc3)n2)nc(-c2cc(C)ccc2)o1

InChI

InChI=1S/C23H21N3O3S/c1-14-6-4-8-17(10-14)22-24-20(15(2)29-22)13-30-23-25-19(12-21(27)26-23)16-7-5-9-18(11-16)28-3/h4-12H,13H2,1-3H3,(H,25,26,27)

InChI Key

KGSUHGTXAHWVRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD16635598

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

419.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.449

Distribution Coefficient, logD

5.212

Water Solubility, LogSw

-5.34

Polar Surface Area

59.913

Acid Dissociation Constant (pKa)

7.54

Base Dissociation Constant (pKb)

3.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.40

F407-0463 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F407-0463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F407-0463?
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What is the minimum amount of F407-0463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F407-0463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F407-0463
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of F407-0463 available by request