G415-3610 Screening compound: 2-(4-ethylpiperazin-1-yl)-4-methyl-N-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carboxamide

G415-3610 Screening compound: 2-(4-ethylpiperazin-1-yl)-4-methyl-N-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carboxamide
G415-3610 Screening compound: 2-(4-ethylpiperazin-1-yl)-4-methyl-N-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G415-3610
2-(4-ethylpiperazin-1-yl)-4-methyl-N-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carboxamide

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

G415-3610

Molecular Formula

C19H22F3N5O2 (C19 H22 F3 N5 O2)

Compound Name

2-(4-ethylpiperazin-1-yl)-4-methyl-N-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carboxamide

IUPAC name

2-(4-ethylpiperazin-1-yl)-4-methyl-N-[4-(trifluoromethoxy)phenyl]pyrimidine-5-carboxamide

SMILES

CCN(CC1)CCN1c(nc1)nc(C)c1C(Nc(cc1)ccc1OC(F)(F)F)=O

InChI

InChI=1S/C19H22F3N5O2/c1-3-26-8-10-27(11-9-26)18-23-12-16(13(2)24-18)17(28)25-14-4-6-15(7-5-14)29-19(20,21)22/h4-7,12H,3,8-11H2,1-2H3,(H,25,28)

InChI Key

OYYZMKMQFFZBGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15011065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.41

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.296

Distribution Coefficient, logD

2.606

Water Solubility, LogSw

-3.62

Polar Surface Area

54.852

Acid Dissociation Constant (pKa)

9.47

Base Dissociation Constant (pKb)

7.99

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

G415-3610 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with G415-3610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G415-3610?
Check Price and Availability of G415-3610, 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 G415-3610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G415-3610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G415-3610
  • 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 G415-3610 available by request