C683-0109 Screening compound: N-(2,3-dimethylphenyl)-2-({9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide

C683-0109 Screening compound: N-(2,3-dimethylphenyl)-2-({9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
C683-0109 Screening compound: N-(2,3-dimethylphenyl)-2-({9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C683-0109
N-(2,3-dimethylphenyl)-2-({9-methoxy-2-phenyl-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

C683-0109

Molecular Formula

C28H25N3O3S (C28 H25 N3 O3 S)

Compound Name

N-(2,3-dimethylphenyl)-2-({9-methoxy-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide

IUPAC name

N-(23-dimethylphenyl)-2-({9-methoxy-2-phenyl-5H-chromeno[23-d]pyrimidin-4-yl}sulfanyl)acetamide

SMILES

Cc1cccc(NC(CSc2nc(-c3ccccc3)nc3c2Cc(cccc2OC)c2O3)=O)c1C

InChI

InChI=1S/C28H25N3O3S/c1-17-9-7-13-22(18(17)2)29-24(32)16-35-28-21-15-20-12-8-14-23(33-3)25(20)34-27(21)30-26(31-28)19-10-5-4-6-11-19/h4-14H,15-16H2,1-3H3,(H,29,32)

InChI Key

KHBBXOVUVVBFSQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06743536

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.59

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.020

Distribution Coefficient, logD

7.017

Water Solubility, LogSw

-5.90

Polar Surface Area

55.897

Acid Dissociation Constant (pKa)

9.55

Base Dissociation Constant (pKb)

1.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

References: we are preparing a list of scientific research reports with C683-0109 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of C683-0109 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C683-0109
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C683-0109
  • 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 C683-0109 available by request