C683-0274 Screening compound: 2-{[2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide

C683-0274 Screening compound: 2-{[2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
C683-0274 Screening compound: 2-{[2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C683-0274
2-{[2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide

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

C683-0274

Molecular Formula

C27H23N3O3S (C27 H23 N3 O3 S)

Compound Name

2-{[2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide

IUPAC name

2-{[2-(4-methoxyphenyl)-5H-chromeno[23-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide

SMILES

CN(C(CSc1nc(-c(cc2)ccc2OC)nc2c1Cc(cccc1)c1O2)=O)c1ccccc1

InChI

InChI=1S/C27H23N3O3S/c1-30(20-9-4-3-5-10-20)24(31)17-34-27-22-16-19-8-6-7-11-23(19)33-26(22)28-25(29-27)18-12-14-21(32-2)15-13-18/h3-15H,16-17H2,1-2H3

InChI Key

ZSEVUJHMLCBGLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06402878

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.095

Distribution Coefficient, logD

6.092

Water Solubility, LogSw

-5.65

Polar Surface Area

48.788

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

0.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.80

C683-0274 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 C683-0274 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C683-0274?
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What is the minimum amount of C683-0274 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C683-0274
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C683-0274
  • 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 C683-0274 available by request