4215-0038 Screening compound: 2-chloro-5-fluoro-N-(prop-2-en-1-yl)pyrimidin-4-amine

4215-0038 Screening compound: 2-chloro-5-fluoro-N-(prop-2-en-1-yl)pyrimidin-4-amine
4215-0038 Screening compound: 2-chloro-5-fluoro-N-(prop-2-en-1-yl)pyrimidin-4-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4215-0038
2-chloro-5-fluoro-N-(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

4215-0038

Molecular Formula

C7H7ClFN3 (C7 H7 ClFN3)

Compound Name

2-chloro-5-fluoro-N-(prop-2-en-1-yl)pyrimidin-4-amine

IUPAC name

2-chloro-5-fluoro-N-(prop-2-en-1-yl)pyrimidin-4-amine

SMILES

C=CCNc(nc(nc1)Cl)c1F

InChI

InChI=1S/C7H7ClFN3/c1-2-3-10-6-5(9)4-11-7(8)12-6/h2,4H,1,3H2,(H,10,11,12)

InChI Key

MMRXDSIENIYMFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02629714

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

187.6

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.773

Distribution Coefficient, logD

1.773

Water Solubility, LogSw

-2.17

Polar Surface Area

30.053

Acid Dissociation Constant (pKa)

13.42

Base Dissociation Constant (pKb)

0.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

4215-0038 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4215-0038 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4215-0038?
Check Price and Availability of 4215-0038, 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 4215-0038 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4215-0038
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4215-0038
  • 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 4215-0038 available by request