G604-0101 Screening compound: 2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)-N-phenylacetamide

G604-0101 Screening compound: 2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)-N-phenylacetamide
G604-0101 Screening compound: 2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)-N-phenylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G604-0101
2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-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

G604-0101

Molecular Formula

C19H14F3N3O4S2 (C19 H14 F3 N3 O4 S2)

Compound Name

2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)-N-phenylacetamide

IUPAC name

2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-16-dihydropyrimidin-2-yl}sulfanyl)-N-phenylacetamide

SMILES

O=C(CSC(NC1=O)=NC=C1S(c1cc(C(F)(F)F)ccc1)(=O)=O)Nc1ccccc1

InChI

InChI=1S/C19H14F3N3O4S2/c20-19(21,22)12-5-4-8-14(9-12)31(28,29)15-10-23-18(25-17(15)27)30-11-16(26)24-13-6-2-1-3-7-13/h1-10H,11H2,(H,24,26)(H,23,25,27)

InChI Key

ZJEUXCYLEMNZMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27145866

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

469.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.514

Distribution Coefficient, logD

0.872

Water Solubility, LogSw

-3.07

Polar Surface Area

87.140

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 G604-0101 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G604-0101?
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What is the minimum amount of G604-0101 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G604-0101
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G604-0101
  • 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 G604-0101 available by request