G605-0868 Screening compound: 2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzenesulfonyl)-3,4-dihydropyrimidin-4-one

G605-0868 Screening compound: 2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzenesulfonyl)-3,4-dihydropyrimidin-4-one
G605-0868 Screening compound: 2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzenesulfonyl)-3,4-dihydropyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound G605-0868
2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzenesulfonyl)-3,4-dihydropyrimidin-4-one

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

G605-0868

Molecular Formula

C23H23FN4O5S2 (C23 H23 FN4 O5 S2)

Compound Name

2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzenesulfonyl)-3,4-dihydropyrimidin-4-one

IUPAC name

2-({2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-5-(4-methoxybenzenesulfonyl)-34-dihydropyrimidin-4-one

SMILES

COc(cc1)ccc1S(C(C(N1)=O)=CN=C1SCC(N(CC1)CCN1c(cc1)ccc1F)=O)(=O)=O

InChI

InChI=1S/C23H23FN4O5S2/c1-33-18-6-8-19(9-7-18)35(31,32)20-14-25-23(26-22(20)30)34-15-21(29)28-12-10-27(11-13-28)17-4-2-16(24)3-5-17/h2-9,14H,10-13,15H2,1H3,(H,25,26,30)

InChI Key

URNDVLQMILGEAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27145994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

518.59

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.050

Distribution Coefficient, logD

0.408

Water Solubility, LogSw

-2.78

Polar Surface Area

91.187

Acid Dissociation Constant (pKa)

5.77

Base Dissociation Constant (pKb)

5.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.10

References: we are preparing a list of scientific research reports with G605-0868 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G605-0868?
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What is the minimum amount of G605-0868 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G605-0868
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G605-0868
  • 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 G605-0868 available by request