V011-4647 Screening compound: 3-[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(4-ethylpiperazin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

V011-4647 Screening compound: 3-[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(4-ethylpiperazin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
V011-4647 Screening compound: 3-[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(4-ethylpiperazin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-4647
3-[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(4-ethylpiperazin-1-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

V011-4647

Molecular Formula

C28H30ClN5O5 (C28 H30 ClN5 O5)

Compound Name

3-[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(4-ethylpiperazin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

IUPAC name

3-[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]-1-(24-dimethoxyphenyl)-4-(4-ethylpiperazin-1-yl)-25-dihydro-1H-pyrrole-25-dione

SMILES

CCN(CC1)CCN1C(C(N1c(ccc(OC)c2)c2OC)=O)=C(c(c(C)nn2-c3cccc(Cl)c3)c2O)C1=O

InChI

InChI=1S/C28H30ClN5O5/c1-5-31-11-13-32(14-12-31)25-24(23-17(2)30-34(27(23)36)19-8-6-7-18(29)15-19)26(35)33(28(25)37)21-10-9-20(38-3)16-22(21)39-4/h6-10,15-16,36H,5,11-14H2,1-4H3

InChI Key

AGVUVMOYOLEPEF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19798423

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

552.03

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

2.809

Distribution Coefficient, logD

2.809

Water Solubility, LogSw

-3.16

Polar Surface Area

80.510

Acid Dissociation Constant (pKa)

5.29

Base Dissociation Constant (pKb)

7.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

V011-4647 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Nucleoside Mimetics Library (2197 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Cancer
  • Immune system
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with V011-4647 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-4647?
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What is the minimum amount of V011-4647 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-4647
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-4647
  • 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 V011-4647 available by request