F725-0642 Screening compound: N-butyl-N-ethyl-3-{[6-(4-methylphenyl)pyrimidin-4-yl]amino}benzamide

F725-0642 Screening compound: N-butyl-N-ethyl-3-{[6-(4-methylphenyl)pyrimidin-4-yl]amino}benzamide
F725-0642 Screening compound: N-butyl-N-ethyl-3-{[6-(4-methylphenyl)pyrimidin-4-yl]amino}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F725-0642
N-butyl-N-ethyl-3-{[6-(4-methylphenyl)pyrimidin-4-yl]amino}benzamide

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

F725-0642

Molecular Formula

C24H28N4O (C24 H28 N4 O)

Compound Name

N-butyl-N-ethyl-3-{[6-(4-methylphenyl)pyrimidin-4-yl]amino}benzamide

IUPAC name

N-butyl-N-ethyl-3-{[6-(4-methylphenyl)pyrimidin-4-yl]amino}benzamide

SMILES

CCCCN(CC)C(c1cc(Nc2ncnc(-c3ccc(C)cc3)c2)ccc1)=O

InChI

InChI=1S/C24H28N4O/c1-4-6-14-28(5-2)24(29)20-8-7-9-21(15-20)27-23-16-22(25-17-26-23)19-12-10-18(3)11-13-19/h7-13,15-17H,4-6,14H2,1-3H3,(H,25,26,27)

InChI Key

XMFJAUXYKQQSFD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14964841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.51

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.926

Distribution Coefficient, logD

5.550

Water Solubility, LogSw

-5.41

Polar Surface Area

45.442

Acid Dissociation Constant (pKa)

19.62

Base Dissociation Constant (pKb)

7.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

F725-0642 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system

References: we are preparing a list of scientific research reports with F725-0642 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F725-0642?
Check Price and Availability of F725-0642, 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 F725-0642 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F725-0642
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F725-0642
  • 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 F725-0642 available by request