3379-0831 Screening compound: N2-cyano-N2-(prop-2-en-1-yl)-N4,N6-bis(propan-2-yl)-1,3,5-triazine-2,4,6-triamine

3379-0831 Screening compound: N2-cyano-N2-(prop-2-en-1-yl)-N4,N6-bis(propan-2-yl)-1,3,5-triazine-2,4,6-triamine
3379-0831 Screening compound: N2-cyano-N2-(prop-2-en-1-yl)-N4,N6-bis(propan-2-yl)-1,3,5-triazine-2,4,6-triamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3379-0831
N2-cyano-N2-(prop-2-en-1-yl)-N4,N6-bis(propan-2-yl)-1,3,5-triazine-2,4,6-triamine

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

3379-0831

Molecular Formula

C13H21N7 (C13 H21 N7)

Compound Name

N2-cyano-N2-(prop-2-en-1-yl)-N4,N6-bis(propan-2-yl)-1,3,5-triazine-2,4,6-triamine

IUPAC name

N2-cyano-N2-(prop-2-en-1-yl)-N4N6-bis(propan-2-yl)-135-triazine-246-triamine

SMILES

CC(C)Nc1nc(N(CC=C)C#N)nc(NC(C)C)n1

InChI

InChI=1S/C13H21N7/c1-6-7-20(8-14)13-18-11(15-9(2)3)17-12(19-13)16-10(4)5/h6,9-10H,1,7H2,2-5H3,(H2,15,16,17,18,19)

InChI Key

MALGHLAZCXQCPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01564761

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

275.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.404

Distribution Coefficient, logD

3.402

Water Solubility, LogSw

-3.66

Polar Surface Area

68.448

Acid Dissociation Constant (pKa)

15.90

Base Dissociation Constant (pKb)

5.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.80

3379-0831 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

?ysteine Targeted Covalent Library (39471 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 3379-0831 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3379-0831?
Check Price and Availability of 3379-0831, 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 3379-0831 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3379-0831
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3379-0831
  • 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 3379-0831 available by request