5664-0117 Screening compound: 2-({4,6-bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl}(cyano)amino)-N,N-diethylpropanamide

5664-0117 Screening compound: 2-({4,6-bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl}(cyano)amino)-N,N-diethylpropanamide
5664-0117 Screening compound: 2-({4,6-bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl}(cyano)amino)-N,N-diethylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5664-0117
2-({4,6-bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl}(cyano)amino)-N,N-diethylpropanamide

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

5664-0117

Molecular Formula

C17H30N8O (C17 H30 N8 O)

Compound Name

2-({4,6-bis[(propan-2-yl)amino]-1,3,5-triazin-2-yl}(cyano)amino)-N,N-diethylpropanamide

IUPAC name

2-({46-bis[(propan-2-yl)amino]-135-triazin-2-yl}(cyano)amino)-NN-diethylpropanamide

SMILES

CCN(CC)C(C(C)N(c1nc(NC(C)C)nc(NC(C)C)n1)C#N)=O

InChI

InChI=1S/C17H30N8O/c1-8-24(9-2)14(26)13(7)25(10-18)17-22-15(19-11(3)4)21-16(23-17)20-12(5)6/h11-13H,8-9H2,1-7H3,(H2,19,20,21,22,23)/t13-/m0/s1

InChI Key

SDTZSAWENVEQNC-ZDUSSCGKSA-N

MDL Number (MFCD)

MFCD01858447

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.48

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.039

Distribution Coefficient, logD

3.038

Water Solubility, LogSw

-3.24

Polar Surface Area

83.766

Acid Dissociation Constant (pKa)

10.21

Base Dissociation Constant (pKb)

4.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

70.60

5664-0117 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5664-0117 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5664-0117?
Check Price and Availability of 5664-0117, 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 5664-0117 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5664-0117
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5664-0117
  • 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 5664-0117 available by request