V017-1690 Screening compound: 3-[1-(4-chlorophenyl)-5-hydroxy-3-(propan-2-yl)-1H-pyrazol-4-yl]-1-(2-fluorophenyl)-4-(4-methylpiperidin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

V017-1690 Screening compound: 3-[1-(4-chlorophenyl)-5-hydroxy-3-(propan-2-yl)-1H-pyrazol-4-yl]-1-(2-fluorophenyl)-4-(4-methylpiperidin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
V017-1690 Screening compound: 3-[1-(4-chlorophenyl)-5-hydroxy-3-(propan-2-yl)-1H-pyrazol-4-yl]-1-(2-fluorophenyl)-4-(4-methylpiperidin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound V017-1690
3-[1-(4-chlorophenyl)-5-hydroxy-3-(propan-2-yl)-1H-pyrazol-4-yl]-1-(2-fluorophenyl)-4-(4-methylpiperidin-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

V017-1690

Molecular Formula

C28H28ClFN4O3 (C28 H28 ClFN4 O3)

Compound Name

3-[1-(4-chlorophenyl)-5-hydroxy-3-(propan-2-yl)-1H-pyrazol-4-yl]-1-(2-fluorophenyl)-4-(4-methylpiperidin-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

IUPAC name

3-[1-(4-chlorophenyl)-5-hydroxy-3-(propan-2-yl)-1H-pyrazol-4-yl]-1-(2-fluorophenyl)-4-(4-methylpiperidin-1-yl)-25-dihydro-1H-pyrrole-25-dione

SMILES

CC(C)c(c(C(C(N(C1=O)c(cccc2)c2F)=O)=C1N1CCC(C)CC1)c1O)nn1-c(cc1)ccc1Cl

InChI

InChI=1S/C28H28ClFN4O3/c1-16(2)24-22(27(36)34(31-24)19-10-8-18(29)9-11-19)23-25(32-14-12-17(3)13-15-32)28(37)33(26(23)35)21-7-5-4-6-20(21)30/h4-11,16-17,36H,12-15H2,1-3H3

InChI Key

KUPPUMZADBEGLI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19798263

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

523.01

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.460

Distribution Coefficient, logD

3.982

Water Solubility, LogSw

-5.74

Polar Surface Area

61.993

Acid Dissociation Constant (pKa)

5.94

Base Dissociation Constant (pKb)

-9.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

32.10

V017-1690 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 V017-1690 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V017-1690?
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What is the minimum amount of V017-1690 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V017-1690
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V017-1690
  • 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 V017-1690 available by request