V028-4467 Screening compound: N-[4-({4-[(4-fluorophenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-phenylpropanamide

V028-4467 Screening compound: N-[4-({4-[(4-fluorophenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-phenylpropanamide
V028-4467 Screening compound: N-[4-({4-[(4-fluorophenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-4467
N-[4-({4-[(4-fluorophenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]-3-phenylpropanamide

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

V028-4467

Molecular Formula

C29H28FN3O4S (C29 H28 FN3 O4 S)

Compound Name

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

IUPAC name

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

SMILES

COCCCN(C(C(Nc(cc1)ccc1F)=C1Sc(cc2)ccc2NC(CCc2ccccc2)=O)=O)C1=O

InChI

InChI=1S/C29H28FN3O4S/c1-37-19-5-18-33-28(35)26(32-23-11-9-21(30)10-12-23)27(29(33)36)38-24-15-13-22(14-16-24)31-25(34)17-8-20-6-3-2-4-7-20/h2-4,6-7,9-16,32H,5,8,17-19H2,1H3,(H,31,34)

InChI Key

FDZAQILGQIVHIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20496703

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

533.62

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.714

Distribution Coefficient, logD

4.658

Water Solubility, LogSw

-4.34

Polar Surface Area

70.073

Acid Dissociation Constant (pKa)

8.26

Base Dissociation Constant (pKb)

2.33

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

References: we are preparing a list of scientific research reports with V028-4467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-4467?
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What is the minimum amount of V028-4467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-4467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-4467
  • 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 V028-4467 available by request