C716-0620 Screening compound: 2-{[5-(3-chloro-4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide

C716-0620 Screening compound: 2-{[5-(3-chloro-4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide
C716-0620 Screening compound: 2-{[5-(3-chloro-4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C716-0620
2-{[5-(3-chloro-4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-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

C716-0620

Molecular Formula

C19H16ClN3O5S2 (C19 H16 ClN3 O5 S2)

Compound Name

2-{[5-(3-chloro-4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide

IUPAC name

2-{[5-(3-chloro-4-methoxybenzenesulfonyl)-6-oxo-16-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide

SMILES

COc(ccc(S(C(C(N1)=O)=CN=C1SCC(Nc1ccccc1)=O)(=O)=O)c1)c1Cl

InChI

InChI=1S/C19H16ClN3O5S2/c1-28-15-8-7-13(9-14(15)20)30(26,27)16-10-21-19(23-18(16)25)29-11-17(24)22-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,22,24)(H,21,23,25)

InChI Key

FYUZAMWCNDSDTF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08140718

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

465.94

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.967

Distribution Coefficient, logD

0.326

Water Solubility, LogSw

-2.93

Polar Surface Area

94.771

Acid Dissociation Constant (pKa)

5.77

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

References: we are preparing a list of scientific research reports with C716-0620 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C716-0620?
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What is the minimum amount of C716-0620 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C716-0620
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C716-0620
  • 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 C716-0620 available by request