V029-7928 Screening compound: N-[4-({4-[(4-fluorophenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

V029-7928 Screening compound: N-[4-({4-[(4-fluorophenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide
V029-7928 Screening compound: N-[4-({4-[(4-fluorophenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V029-7928
N-[4-({4-[(4-fluorophenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

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

V029-7928

Molecular Formula

C28H26FN3O4S (C28 H26 FN3 O4 S)

Compound Name

N-[4-({4-[(4-fluorophenyl)amino]-1-(4-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

IUPAC name

N-[4-({4-[(4-fluorophenyl)amino]-1-(4-methoxyphenyl)-25-dioxo-25-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-methylbutanamide

SMILES

CC(C)CC(Nc(cc1)ccc1SC(C(N(C1=O)c(cc2)ccc2OC)=O)=C1Nc(cc1)ccc1F)=O

InChI

InChI=1S/C28H26FN3O4S/c1-17(2)16-24(33)30-19-8-14-23(15-9-19)37-26-25(31-20-6-4-18(29)5-7-20)27(34)32(28(26)35)21-10-12-22(36-3)13-11-21/h4-15,17,31H,16H2,1-3H3,(H,30,33)

InChI Key

CLWQLVMOAZVVCE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497519

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

519.6

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.058

Distribution Coefficient, logD

5.057

Water Solubility, LogSw

-4.58

Polar Surface Area

68.684

Acid Dissociation Constant (pKa)

10.83

Base Dissociation Constant (pKb)

-6.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.90

References: we are preparing a list of scientific research reports with V029-7928 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V029-7928?
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What is the minimum amount of V029-7928 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V029-7928
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V029-7928
  • 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 V029-7928 available by request