J033-0150 Screening compound: 2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}quinazolin-4-ol

J033-0150 Screening compound: 2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}quinazolin-4-ol
J033-0150 Screening compound: 2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}quinazolin-4-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound J033-0150
2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}quinazolin-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

J033-0150

Molecular Formula

C17H17N3O2S (C17 H17 N3 O2 S)

Compound Name

2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfanyl}quinazolin-4-ol

IUPAC name

2-{[(4-methoxy-35-dimethylpyridin-2-yl)methyl]sulfanyl}quinazolin-4-ol

SMILES

Cc1cnc(CSc2nc3ccccc3c(O)n2)c(C)c1OC

InChI

InChI=1S/C17H17N3O2S/c1-10-8-18-14(11(2)15(10)22-3)9-23-17-19-13-7-5-4-6-12(13)16(21)20-17/h4-8H,9H2,1-3H3,(H,19,20,21)

InChI Key

VNVBLZCHPUPMDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD12965346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

327.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.395

Distribution Coefficient, logD

3.198

Water Solubility, LogSw

-3.29

Polar Surface Area

52.056

Acid Dissociation Constant (pKa)

8.06

Base Dissociation Constant (pKb)

6.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

J033-0150 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with J033-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J033-0150?
Check Price and Availability of J033-0150, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of J033-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J033-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J033-0150
  • 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 J033-0150 available by request