V026-4580 Screening compound: 3-(1-tert-butyl-5-hydroxy-3-phenyl-1H-pyrazol-4-yl)-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

V026-4580 Screening compound: 3-(1-tert-butyl-5-hydroxy-3-phenyl-1H-pyrazol-4-yl)-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
V026-4580 Screening compound: 3-(1-tert-butyl-5-hydroxy-3-phenyl-1H-pyrazol-4-yl)-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V026-4580
3-(1-tert-butyl-5-hydroxy-3-phenyl-1H-pyrazol-4-yl)-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

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

V026-4580

Molecular Formula

C29H32N4O6 (C29 H32 N4 O6)

Compound Name

3-(1-tert-butyl-5-hydroxy-3-phenyl-1H-pyrazol-4-yl)-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

IUPAC name

3-(1-tert-butyl-5-hydroxy-3-phenyl-1H-pyrazol-4-yl)-1-(24-dimethoxyphenyl)-4-(morpholin-4-yl)-25-dihydro-1H-pyrrole-25-dione

SMILES

CC(C)(C)n(c(O)c1C(C(N(C2=O)c(ccc(OC)c3)c3OC)=O)=C2N2CCOCC2)nc1-c1ccccc1

InChI

InChI=1S/C29H32N4O6/c1-29(2,3)33-27(35)22(24(30-33)18-9-7-6-8-10-18)23-25(31-13-15-39-16-14-31)28(36)32(26(23)34)20-12-11-19(37-4)17-21(20)38-5/h6-12,17,35H,13-16H2,1-5H3

InChI Key

KFAIUCNLONFRST-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19802625

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

532.6

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.860

Distribution Coefficient, logD

0.408

Water Solubility, LogSw

-3.23

Polar Surface Area

85.771

Acid Dissociation Constant (pKa)

4.73

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.48

V026-4580 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V026-4580 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V026-4580?
Check Price and Availability of V026-4580, 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 V026-4580 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V026-4580
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V026-4580
  • 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 V026-4580 available by request