V027-4087 Screening compound: 5-[(2-chloro-6-fluorophenyl)methyl]-4-(4-cyclobutanecarbonylpiperazin-1-yl)-6-ethyl-2-(propan-2-yl)pyrimidine

V027-4087 Screening compound: 5-[(2-chloro-6-fluorophenyl)methyl]-4-(4-cyclobutanecarbonylpiperazin-1-yl)-6-ethyl-2-(propan-2-yl)pyrimidine
V027-4087 Screening compound: 5-[(2-chloro-6-fluorophenyl)methyl]-4-(4-cyclobutanecarbonylpiperazin-1-yl)-6-ethyl-2-(propan-2-yl)pyrimidine alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-4087
5-[(2-chloro-6-fluorophenyl)methyl]-4-(4-cyclobutanecarbonylpiperazin-1-yl)-6-ethyl-2-(propan-2-yl)pyrimidine

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

V027-4087

Molecular Formula

C25H32ClFN4O (C25 H32 ClFN4 O)

Compound Name

5-[(2-chloro-6-fluorophenyl)methyl]-4-(4-cyclobutanecarbonylpiperazin-1-yl)-6-ethyl-2-(propan-2-yl)pyrimidine

IUPAC name

5-[(2-chloro-6-fluorophenyl)methyl]-4-(4-cyclobutanecarbonylpiperazin-1-yl)-6-ethyl-2-(propan-2-yl)pyrimidine

SMILES

CCc1nc(C(C)C)nc(N(CC2)CCN2C(C2CCC2)=O)c1Cc(c(F)ccc1)c1Cl

InChI

InChI=1S/C25H32ClFN4O/c1-4-22-19(15-18-20(26)9-6-10-21(18)27)24(29-23(28-22)16(2)3)30-11-13-31(14-12-30)25(32)17-7-5-8-17/h6,9-10,16-17H,4-5,7-8,11-15H2,1-3H3

InChI Key

NPPYONWKGFHGHP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19786558

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

459.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.601

Distribution Coefficient, logD

5.544

Water Solubility, LogSw

-5.85

Polar Surface Area

40.169

Acid Dissociation Constant (pKa)

21.42

Base Dissociation Constant (pKb)

6.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

V027-4087 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 V027-4087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-4087?
Check Price and Availability of V027-4087, 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 V027-4087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-4087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-4087
  • 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 V027-4087 available by request