V001-3716 Screening compound: 6-(2-chloro-4-fluorophenoxy)-N,N-bis(prop-2-en-1-yl)pyrimidin-4-amine

V001-3716 Screening compound: 6-(2-chloro-4-fluorophenoxy)-N,N-bis(prop-2-en-1-yl)pyrimidin-4-amine
V001-3716 Screening compound: 6-(2-chloro-4-fluorophenoxy)-N,N-bis(prop-2-en-1-yl)pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound V001-3716
6-(2-chloro-4-fluorophenoxy)-N,N-bis(prop-2-en-1-yl)pyrimidin-4-amine

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

V001-3716

Molecular Formula

C16H15ClFN3O (C16 H15 ClFN3 O)

Compound Name

6-(2-chloro-4-fluorophenoxy)-N,N-bis(prop-2-en-1-yl)pyrimidin-4-amine

IUPAC name

6-(2-chloro-4-fluorophenoxy)-NN-bis(prop-2-en-1-yl)pyrimidin-4-amine

SMILES

C=CCN(CC=C)c1cc(Oc(ccc(F)c2)c2Cl)ncn1

InChI

InChI=1S/C16H15ClFN3O/c1-3-7-21(8-4-2)15-10-16(20-11-19-15)22-14-6-5-12(18)9-13(14)17/h3-6,9-11H,1-2,7-8H2

InChI Key

BZNQEVMVMMMVBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19862155

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

319.77

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.339

Distribution Coefficient, logD

4.339

Water Solubility, LogSw

-4.55

Polar Surface Area

29.490

Acid Dissociation Constant (pKa)

25.27

Base Dissociation Constant (pKb)

2.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

V001-3716 in Drug Discovery

Included in Screening Libraries

Antibacterial Compounds Library (13827 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with V001-3716 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V001-3716?
Check Price and Availability of V001-3716, 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 V001-3716 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V001-3716
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V001-3716
  • 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 V001-3716 available by request