G786-0154 Screening compound: 2-(morpholin-4-yl)-5-nitro-N4-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine

G786-0154 Screening compound: 2-(morpholin-4-yl)-5-nitro-N4-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine
G786-0154 Screening compound: 2-(morpholin-4-yl)-5-nitro-N4-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine alternative view

Chemical Structure Depiction of ChemDiv screening compound G786-0154
2-(morpholin-4-yl)-5-nitro-N4-[(oxolan-2-yl)methyl]pyrimidine-4,6-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

G786-0154

Molecular Formula

C13H20N6O4 (C13 H20 N6 O4)

Compound Name

2-(morpholin-4-yl)-5-nitro-N4-[(oxolan-2-yl)methyl]pyrimidine-4,6-diamine

IUPAC name

2-(morpholin-4-yl)-5-nitro-N4-[(oxolan-2-yl)methyl]pyrimidine-46-diamine

SMILES

Nc1nc(N2CCOCC2)nc(NCC2OCCC2)c1[N+]([O-])=O

InChI

InChI=1S/C13H20N6O4/c14-11-10(19(20)21)12(15-8-9-2-1-5-23-9)17-13(16-11)18-3-6-22-7-4-18/h9H,1-8H2,(H3,14,15,16,17)/t9-/m1/s1

InChI Key

OTUVTDZHRMNPIX-SECBINFHSA-N

MDL Number (MFCD)

MFCD04033384

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

0.875

Distribution Coefficient, logD

0.875

Water Solubility, LogSw

-1.43

Polar Surface Area

102.103

Acid Dissociation Constant (pKa)

13.95

Base Dissociation Constant (pKb)

3.11

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

69.20

G786-0154 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G786-0154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G786-0154?
Check Price and Availability of G786-0154, 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 G786-0154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G786-0154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G786-0154
  • 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 G786-0154 available by request