V028-7209 Screening compound: 2,4-dimethoxy-N-(3-{[1-(3-methoxypropyl)-2,5-dioxo-4-{[4-(propan-2-yl)phenyl]amino}-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide

V028-7209 Screening compound: 2,4-dimethoxy-N-(3-{[1-(3-methoxypropyl)-2,5-dioxo-4-{[4-(propan-2-yl)phenyl]amino}-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide
V028-7209 Screening compound: 2,4-dimethoxy-N-(3-{[1-(3-methoxypropyl)-2,5-dioxo-4-{[4-(propan-2-yl)phenyl]amino}-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-7209
2,4-dimethoxy-N-(3-{[1-(3-methoxypropyl)-2,5-dioxo-4-{[4-(propan-2-yl)phenyl]amino}-2,5-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide

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

V028-7209

Molecular Formula

C32H35N3O6S (C32 H35 N3 O6 S)

Compound Name

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

IUPAC name

24-dimethoxy-N-(3-{[1-(3-methoxypropyl)-25-dioxo-4-{[4-(propan-2-yl)phenyl]amino}-25-dihydro-1H-pyrrol-3-yl]sulfanyl}phenyl)benzamide

SMILES

CC(C)c(cc1)ccc1NC(C(N(CCCOC)C1=O)=O)=C1Sc1cc(NC(c(ccc(OC)c2)c2OC)=O)ccc1

InChI

InChI=1S/C32H35N3O6S/c1-20(2)21-10-12-22(13-11-21)33-28-29(32(38)35(31(28)37)16-7-17-39-3)42-25-9-6-8-23(18-25)34-30(36)26-15-14-24(40-4)19-27(26)41-5/h6,8-15,18-20,33H,7,16-17H2,1-5H3,(H,34,36)

InChI Key

WHGIANAULLSECU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497642

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

589.71

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

5.562

Distribution Coefficient, logD

5.561

Water Solubility, LogSw

-5.30

Polar Surface Area

85.461

Acid Dissociation Constant (pKa)

9.94

Base Dissociation Constant (pKb)

2.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.10

V028-7209 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with V028-7209 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-7209?
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What is the minimum amount of V028-7209 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-7209
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-7209
  • 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 V028-7209 available by request