8014-8105 Screening compound: N~1~-(4-methoxyphenyl)-2-[5-oxo-1-phenyl-3-(2,3,4,5-tetrafluorobenzyl)-2-thioxo-4-imidazolidinyl]acetamide

8014-8105 Screening compound: N~1~-(4-methoxyphenyl)-2-[5-oxo-1-phenyl-3-(2,3,4,5-tetrafluorobenzyl)-2-thioxo-4-imidazolidinyl]acetamide
8014-8105 Screening compound: N~1~-(4-methoxyphenyl)-2-[5-oxo-1-phenyl-3-(2,3,4,5-tetrafluorobenzyl)-2-thioxo-4-imidazolidinyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-8105
N~1~-(4-methoxyphenyl)-2-[5-oxo-1-phenyl-3-(2,3,4,5-tetrafluorobenzyl)-2-thioxo-4-imidazolidinyl]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

8014-8105

Molecular Formula

C25H19F4N3O3S (C25 H19 F4 N3 O3 S)

Compound Name

N~1~-(4-methoxyphenyl)-2-[5-oxo-1-phenyl-3-(2,3,4,5-tetrafluorobenzyl)-2-thioxo-4-imidazolidinyl]acetamide

IUPAC name

N-(4-methoxyphenyl)-2-{5-oxo-1-phenyl-2-sulfanylidene-3-[(2345-tetrafluorophenyl)methyl]imidazolidin-4-yl}acetamide

SMILES

COc(cc1)ccc1NC(CC(C(N1c2ccccc2)=O)N(Cc(cc(c(F)c2F)F)c2F)C1=S)=O

InChI

InChI=1S/C25H19F4N3O3S/c1-35-17-9-7-15(8-10-17)30-20(33)12-19-24(34)32(16-5-3-2-4-6-16)25(36)31(19)13-14-11-18(26)22(28)23(29)21(14)27/h2-11,19H,12-13H2,1H3,(H,30,33)/t19-/m1/s1

InChI Key

DQVMNRIWOVJORT-LJQANCHMSA-N

MDL Number (MFCD)

MFCD03674162

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

517.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.373

Distribution Coefficient, logD

4.373

Water Solubility, LogSw

-4.37

Polar Surface Area

48.941

Acid Dissociation Constant (pKa)

11.86

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

16.00

References: we are preparing a list of scientific research reports with 8014-8105 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-8105?
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What is the minimum amount of 8014-8105 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-8105
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-8105
  • 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 8014-8105 available by request