V008-8103 Screening compound: 1-{4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-4-pyrimidinyl]piperazino}-1-heptanone

V008-8103 Screening compound: 1-{4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-4-pyrimidinyl]piperazino}-1-heptanone
V008-8103 Screening compound: 1-{4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-4-pyrimidinyl]piperazino}-1-heptanone alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-8103
1-{4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-4-pyrimidinyl]piperazino}-1-heptanone

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

V008-8103

Molecular Formula

C25H35FN4O (C25 H35 FN4 O)

Compound Name

1-{4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-4-pyrimidinyl]piperazino}-1-heptanone

IUPAC name

1-(4-{6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl}piperazin-1-yl)heptan-1-one

SMILES

CCCCCCC(N(CC1)CCN1c1c(Cc2cccc(F)c2)c(CC)nc(C)n1)=O

InChI

InChI=1S/C25H35FN4O/c1-4-6-7-8-12-24(31)29-13-15-30(16-14-29)25-22(23(5-2)27-19(3)28-25)18-20-10-9-11-21(26)17-20/h9-11,17H,4-8,12-16,18H2,1-3H3

InChI Key

TYYVJNDZBXKQPV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19763069

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

426.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.858

Distribution Coefficient, logD

5.749

Water Solubility, LogSw

-5.25

Polar Surface Area

39.002

Acid Dissociation Constant (pKa)

21.03

Base Dissociation Constant (pKb)

6.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.00

References: we are preparing a list of scientific research reports with V008-8103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-8103?
Check Price and Availability of V008-8103, 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 V008-8103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-8103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-8103
  • 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 V008-8103 available by request