V003-5600 Screening compound: 1-[4-(2,5-DIMETHOXYPHENYL)-1-(4-METHYLBENZOYL)PYRROLIDINE-3-CARBONYL]-4-METHYLPIPERAZINE

V003-5600 Screening compound: 1-[4-(2,5-DIMETHOXYPHENYL)-1-(4-METHYLBENZOYL)PYRROLIDINE-3-CARBONYL]-4-METHYLPIPERAZINE
V003-5600 Screening compound: 1-[4-(2,5-DIMETHOXYPHENYL)-1-(4-METHYLBENZOYL)PYRROLIDINE-3-CARBONYL]-4-METHYLPIPERAZINE alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-5600
1-[4-(2,5-DIMETHOXYPHENYL)-1-(4-METHYLBENZOYL)PYRROLIDINE-3-CARBONYL]-4-METHYLPIPERAZINE

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

V003-5600

Molecular Formula

C26H33N3O4 (C26 H33 N3 O4)

Compound Name

1-[4-(2,5-DIMETHOXYPHENYL)-1-(4-METHYLBENZOYL)PYRROLIDINE-3-CARBONYL]-4-METHYLPIPERAZINE

IUPAC name

n/a

SMILES

Cc(cc1)ccc1C(N(CC1C(N2CCN(C)CC2)=O)CC1c(cc(cc1)OC)c1OC)=O

InChI

InChI=1S/C26H33N3O4/c1-18-5-7-19(8-6-18)25(30)29-16-22(21-15-20(32-3)9-10-24(21)33-4)23(17-29)26(31)28-13-11-27(2)12-14-28/h5-10,15,22-23H,11-14,16-17H2,1-4H3

InChI Key

XQVPBYFIFRCDJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14262068

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

451.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.718

Distribution Coefficient, logD

2.370

Water Solubility, LogSw

-3.02

Polar Surface Area

52.147

Acid Dissociation Constant (pKa)

21.09

Base Dissociation Constant (pKb)

7.49

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

46.20

V003-5600 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Macl-GPIb alpha Interaction Library (22969 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with V003-5600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-5600?
Check Price and Availability of V003-5600, 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 V003-5600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-5600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-5600
  • 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 V003-5600 available by request