V011-4595 Screening compound: 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(diethylamino)-1-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione

V011-4595 Screening compound: 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(diethylamino)-1-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
V011-4595 Screening compound: 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(diethylamino)-1-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-4595
3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(diethylamino)-1-(4-methoxyphenyl)-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

V011-4595

Molecular Formula

C26H26Cl2N4O4 (C26 H26 Cl2 N4 O4)

Compound Name

3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(diethylamino)-1-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione

IUPAC name

3-[1-(34-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-4-(diethylamino)-1-(4-methoxyphenyl)-25-dihydro-1H-pyrrole-25-dione

SMILES

CCc(c(C(C(N(C1=O)c(cc2)ccc2OC)=O)=C1N(CC)CC)c1O)nn1-c(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C26H26Cl2N4O4/c1-5-20-21(25(34)32(29-20)16-10-13-18(27)19(28)14-16)22-23(30(6-2)7-3)26(35)31(24(22)33)15-8-11-17(36-4)12-9-15/h8-14,34H,5-7H2,1-4H3

InChI Key

WHVVTUIISVASPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19802615

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

529.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.697

Distribution Coefficient, logD

3.085

Water Solubility, LogSw

-4.62

Polar Surface Area

69.617

Acid Dissociation Constant (pKa)

5.58

Base Dissociation Constant (pKb)

6.91

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.92

V011-4595 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 V011-4595 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-4595?
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What is the minimum amount of V011-4595 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-4595
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-4595
  • 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 V011-4595 available by request