G605-0846 Screening compound: N-(3-fluoro-4-methylphenyl)-2-{[5-(4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide

G605-0846 Screening compound: N-(3-fluoro-4-methylphenyl)-2-{[5-(4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
G605-0846 Screening compound: N-(3-fluoro-4-methylphenyl)-2-{[5-(4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G605-0846
N-(3-fluoro-4-methylphenyl)-2-{[5-(4-methoxybenzenesulfonyl)-6-oxo-1,6-dihydropyrimidin-2-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

G605-0846

Molecular Formula

C20H18FN3O5S2 (C20 H18 FN3 O5 S2)

Compound Name

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

IUPAC name

N-(3-fluoro-4-methylphenyl)-2-{[5-(4-methoxybenzenesulfonyl)-6-oxo-16-dihydropyrimidin-2-yl]sulfanyl}acetamide

SMILES

Cc(ccc(NC(CSC(NC1=O)=NC=C1S(c(cc1)ccc1OC)(=O)=O)=O)c1)c1F

InChI

InChI=1S/C20H18FN3O5S2/c1-12-3-4-13(9-16(12)21)23-18(25)11-30-20-22-10-17(19(26)24-20)31(27,28)15-7-5-14(29-2)6-8-15/h3-10H,11H2,1-2H3,(H,23,25)(H,22,24,26)

InChI Key

FNPVVCUNVAPTTB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD11994390

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.51

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

2.651

Distribution Coefficient, logD

1.009

Water Solubility, LogSw

-3.21

Polar Surface Area

94.684

Acid Dissociation Constant (pKa)

5.77

Base Dissociation Constant (pKb)

-0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

G605-0846 in Drug Discovery

Included in Screening Libraries

NOTUM (Wnt signaling) Library (3881 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G605-0846 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G605-0846?
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What is the minimum amount of G605-0846 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G605-0846
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G605-0846
  • 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 G605-0846 available by request