F413-0362 Screening compound: 2-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-3-[(thiophen-2-yl)methyl]-3,4-dihydroquinazolin-4-one

F413-0362 Screening compound: 2-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-3-[(thiophen-2-yl)methyl]-3,4-dihydroquinazolin-4-one
F413-0362 Screening compound: 2-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-3-[(thiophen-2-yl)methyl]-3,4-dihydroquinazolin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F413-0362
2-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-3-[(thiophen-2-yl)methyl]-3,4-dihydroquinazolin-4-one

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

F413-0362

Molecular Formula

C24H18ClN3O2S2 (C24 H18 ClN3 O2 S2)

Compound Name

2-({[2-(3-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-3-[(thiophen-2-yl)methyl]-3,4-dihydroquinazolin-4-one

IUPAC name

2-({[2-(3-chlorophenyl)-5-methyl-13-oxazol-4-yl]methyl}sulfanyl)-3-[(thiophen-2-yl)methyl]-34-dihydroquinazolin-4-one

SMILES

Cc1c(CSC(N2Cc3cccs3)=Nc(cccc3)c3C2=O)nc(-c2cccc(Cl)c2)o1

InChI

InChI=1S/C24H18ClN3O2S2/c1-15-21(26-22(30-15)16-6-4-7-17(25)12-16)14-32-24-27-20-10-3-2-9-19(20)23(29)28(24)13-18-8-5-11-31-18/h2-12H,13-14H2,1H3

InChI Key

NHRVTSZIZIIKCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14954002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.01

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.639

Distribution Coefficient, logD

5.639

Water Solubility, LogSw

-5.77

Polar Surface Area

44.911

Acid Dissociation Constant (pKa)

28.68

Base Dissociation Constant (pKb)

1.39

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

F413-0362 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F413-0362 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F413-0362?
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What is the minimum amount of F413-0362 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F413-0362
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F413-0362
  • 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 F413-0362 available by request