V030-8075 Screening compound: 2-chloro-N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide

V030-8075 Screening compound: 2-chloro-N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide
V030-8075 Screening compound: 2-chloro-N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl}sulfanyl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V030-8075
2-chloro-N-[3-({4-[(2,4-dimethoxyphenyl)amino]-1-(3-methoxypropyl)-2,5-dioxo-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

V030-8075

Molecular Formula

C29H28ClN3O6S (C29 H28 ClN3 O6 S)

Compound Name

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

IUPAC name

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

SMILES

COCCCN(C(C(Nc(ccc(OC)c1)c1OC)=C1Sc2cccc(NC(c(cccc3)c3Cl)=O)c2)=O)C1=O

InChI

InChI=1S/C29H28ClN3O6S/c1-37-15-7-14-33-28(35)25(32-23-13-12-19(38-2)17-24(23)39-3)26(29(33)36)40-20-9-6-8-18(16-20)31-27(34)21-10-4-5-11-22(21)30/h4-6,8-13,16-17,32H,7,14-15H2,1-3H3,(H,31,34)

InChI Key

SOVCQEBBPSLAPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD20497336

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

582.08

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.723

Distribution Coefficient, logD

4.670

Water Solubility, LogSw

-4.82

Polar Surface Area

84.763

Acid Dissociation Constant (pKa)

8.29

Base Dissociation Constant (pKb)

4.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.70

V030-8075 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 V030-8075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V030-8075?
Check Price and Availability of V030-8075, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V030-8075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V030-8075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V030-8075
  • 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 V030-8075 available by request