C683-0078 Screening compound: N-(3-chloro-4-fluorophenyl)-2-({7-methyl-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide

C683-0078 Screening compound: N-(3-chloro-4-fluorophenyl)-2-({7-methyl-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide
C683-0078 Screening compound: N-(3-chloro-4-fluorophenyl)-2-({7-methyl-2-phenyl-5H-chromeno[2,3-d]pyrimidin-4-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C683-0078
N-(3-chloro-4-fluorophenyl)-2-({7-methyl-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

C683-0078

Molecular Formula

C26H19ClFN3O2S (C26 H19 ClFN3 O2 S)

Compound Name

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

IUPAC name

N-(3-chloro-4-fluorophenyl)-2-({7-methyl-2-phenyl-5H-chromeno[23-d]pyrimidin-4-yl}sulfanyl)acetamide

SMILES

Cc(cc1)cc(C2)c1Oc1c2c(SCC(Nc(cc2)cc(Cl)c2F)=O)nc(-c2ccccc2)n1

InChI

InChI=1S/C26H19ClFN3O2S/c1-15-7-10-22-17(11-15)12-19-25(33-22)30-24(16-5-3-2-4-6-16)31-26(19)34-14-23(32)29-18-8-9-21(28)20(27)13-18/h2-11,13H,12,14H2,1H3,(H,29,32)

InChI Key

RSRIEUKKBGCBIC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14782480

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

491.97

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.581

Distribution Coefficient, logD

7.572

Water Solubility, LogSw

-6.35

Polar Surface Area

49.280

Acid Dissociation Constant (pKa)

9.07

Base Dissociation Constant (pKb)

0.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

References: we are preparing a list of scientific research reports with C683-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C683-0078?
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What is the minimum amount of C683-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C683-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C683-0078
  • 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 C683-0078 available by request