G786-0082 Screening compound: N2,N2-diethyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine

G786-0082 Screening compound: N2,N2-diethyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine
G786-0082 Screening compound: N2,N2-diethyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-0082
N2,N2-diethyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine

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

G786-0082

Molecular Formula

C14H25N7O2 (C14 H25 N7 O2)

Compound Name

N2,N2-diethyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-2,4-diamine

IUPAC name

N2N2-diethyl-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidine-24-diamine

SMILES

CCN(CC)c(nc1N)nc(N2CCN(CC)CC2)c1[N+]([O-])=O

InChI

InChI=1S/C14H25N7O2/c1-4-18-7-9-20(10-8-18)13-11(21(22)23)12(15)16-14(17-13)19(5-2)6-3/h4-10H2,1-3H3,(H2,15,16,17)

InChI Key

MECYSSNKITURMJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04031766

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

323.4

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.311

Distribution Coefficient, logD

1.743

Water Solubility, LogSw

-2.20

Polar Surface Area

80.871

Acid Dissociation Constant (pKa)

14.13

Base Dissociation Constant (pKb)

7.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

71.40

G786-0082 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G786-0082 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-0082?
Check Price and Availability of G786-0082, 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 G786-0082 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-0082
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-0082
  • 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 G786-0082 available by request