G604-0148 Screening compound: N-(3-ethylphenyl)-2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide

G604-0148 Screening compound: N-(3-ethylphenyl)-2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
G604-0148 Screening compound: N-(3-ethylphenyl)-2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G604-0148
N-(3-ethylphenyl)-2-({6-oxo-5-[3-(trifluoromethyl)benzenesulfonyl]-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

G604-0148

Molecular Formula

C21H18F3N3O4S2 (C21 H18 F3 N3 O4 S2)

Compound Name

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

IUPAC name

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

SMILES

CCc1cccc(NC(CSC(NC2=O)=NC=C2S(c2cc(C(F)(F)F)ccc2)(=O)=O)=O)c1

InChI

InChI=1S/C21H18F3N3O4S2/c1-2-13-5-3-7-15(9-13)26-18(28)12-32-20-25-11-17(19(29)27-20)33(30,31)16-8-4-6-14(10-16)21(22,23)24/h3-11H,2,12H2,1H3,(H,26,28)(H,25,27,29)

InChI Key

WZOMHALQBXHTLS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09980856

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.52

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.496

Distribution Coefficient, logD

1.855

Water Solubility, LogSw

-3.88

Polar Surface Area

87.140

Acid Dissociation Constant (pKa)

5.77

Base Dissociation Constant (pKb)

-0.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with G604-0148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G604-0148?
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What is the minimum amount of G604-0148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G604-0148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G604-0148
  • 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 G604-0148 available by request