C683-0638 Screening compound: N,N-diethyl-2-{[2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide

C683-0638 Screening compound: N,N-diethyl-2-{[2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
C683-0638 Screening compound: N,N-diethyl-2-{[2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C683-0638
N,N-diethyl-2-{[2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide

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

C683-0638

Molecular Formula

C24H24FN3O2S (C24 H24 FN3 O2 S)

Compound Name

N,N-diethyl-2-{[2-(4-fluorophenyl)-7-methyl-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide

IUPAC name

NN-diethyl-2-{[2-(4-fluorophenyl)-7-methyl-5H-chromeno[23-d]pyrimidin-4-yl]sulfanyl}acetamide

SMILES

CCN(CC)C(CSc1nc(-c(cc2)ccc2F)nc2c1Cc(cc(C)cc1)c1O2)=O

InChI

InChI=1S/C24H24FN3O2S/c1-4-28(5-2)21(29)14-31-24-19-13-17-12-15(3)6-11-20(17)30-23(19)26-22(27-24)16-7-9-18(25)10-8-16/h6-12H,4-5,13-14H2,1-3H3

InChI Key

SOPCPIVOZFRIRC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14782624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.54

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.128

Distribution Coefficient, logD

6.125

Water Solubility, LogSw

-5.53

Polar Surface Area

41.807

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

1.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

C683-0638 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 C683-0638 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C683-0638?
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What is the minimum amount of C683-0638 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C683-0638
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C683-0638
  • 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 C683-0638 available by request