V014-3820 Screening compound: 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione

V014-3820 Screening compound: 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)-4-(morpholin-4-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
V014-3820 Screening compound: 3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-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 V014-3820
3-[1-(3,4-dichlorophenyl)-3-ethyl-5-hydroxy-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

V014-3820

Molecular Formula

C27H26Cl2N4O6 (C27 H26 Cl2 N4 O6)

Compound Name

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

IUPAC name

3-[1-(34-dichlorophenyl)-3-ethyl-5-hydroxy-1H-pyrazol-4-yl]-1-(24-dimethoxyphenyl)-4-(morpholin-4-yl)-25-dihydro-1H-pyrrole-25-dione

SMILES

CCc(c(C(C(N(C1=O)c(ccc(OC)c2)c2OC)=O)=C1N1CCOCC1)c1O)nn1-c(cc1)cc(Cl)c1Cl

InChI

InChI=1S/C27H26Cl2N4O6/c1-4-19-22(26(35)33(30-19)15-5-7-17(28)18(29)13-15)23-24(31-9-11-39-12-10-31)27(36)32(25(23)34)20-8-6-16(37-2)14-21(20)38-3/h5-8,13-14,35H,4,9-12H2,1-3H3

InChI Key

DGGKAIFKYSKOOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19802852

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

573.43

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

3.902

Distribution Coefficient, logD

3.902

Water Solubility, LogSw

-4.17

Polar Surface Area

85.571

Acid Dissociation Constant (pKa)

5.58

Base Dissociation Constant (pKb)

7.35

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.60

V014-3820 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 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 V014-3820 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-3820?
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What is the minimum amount of V014-3820 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-3820
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-3820
  • 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 V014-3820 available by request