V021-4076 Screening compound: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-methylpyrimidine

V021-4076 Screening compound: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-methylpyrimidine
V021-4076 Screening compound: 5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-methylpyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V021-4076
5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-methylpyrimidine

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

V021-4076

Molecular Formula

C25H30N4O2 (C25 H30 N4 O2)

Compound Name

5-[(2,5-dimethylphenyl)methyl]-4-ethyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-methylpyrimidine

IUPAC name

5-[(25-dimethylphenyl)methyl]-4-ethyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-methylpyrimidine

SMILES

CCc1c(Cc2c(C)ccc(C)c2)c(N(CC2)CCN2C(c2ccco2)=O)nc(C)n1

InChI

InChI=1S/C25H30N4O2/c1-5-22-21(16-20-15-17(2)8-9-18(20)3)24(27-19(4)26-22)28-10-12-29(13-11-28)25(30)23-7-6-14-31-23/h6-9,14-15H,5,10-13,16H2,1-4H3

InChI Key

JVBDPLOKJYQOJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19786078

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

418.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.213

Distribution Coefficient, logD

4.796

Water Solubility, LogSw

-5.01

Polar Surface Area

47.837

Acid Dissociation Constant (pKa)

21.05

Base Dissociation Constant (pKb)

7.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V021-4076 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with V021-4076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V021-4076?
Check Price and Availability of V021-4076, 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 V021-4076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V021-4076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V021-4076
  • 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 V021-4076 available by request