8015-2509 Screening compound: (E)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-2-dibenzo[b,d]furan-2-yl-1-ethenyl cyanide

8015-2509 Screening compound: (E)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-2-dibenzo[b,d]furan-2-yl-1-ethenyl cyanide
8015-2509 Screening compound: (E)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-2-dibenzo[b,d]furan-2-yl-1-ethenyl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-2509
(E)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-2-dibenzo[b,d]furan-2-yl-1-ethenyl cyanide

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

8015-2509

Molecular Formula

C20H16N6O (C20 H16 N6 O)

Compound Name

(E)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]-2-dibenzo[b,d]furan-2-yl-1-ethenyl cyanide

IUPAC name

(2E)-2-[4-amino-6-(dimethylamino)-135-triazin-2-yl]-3-{8-oxatricyclo[7.4.0.0^{27}]trideca-1(13)246911-hexaen-4-yl}prop-2-enenitrile

SMILES

CN(C)c1nc(N)nc(/C(/C#N)=C/c(cc2)cc3c2oc2c3cccc2)n1

InChI

InChI=1S/C20H16N6O/c1-26(2)20-24-18(23-19(22)25-20)13(11-21)9-12-7-8-17-15(10-12)14-5-3-4-6-16(14)27-17/h3-10H,1-2H3,(H2,22,23,24,25)

InChI Key

YDBIZEBHSZLUGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03856338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.39

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.533

Distribution Coefficient, logD

4.533

Water Solubility, LogSw

-4.64

Polar Surface Area

77.002

Acid Dissociation Constant (pKa)

16.11

Base Dissociation Constant (pKb)

1.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8015-2509 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8015-2509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-2509?
Check Price and Availability of 8015-2509, 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 8015-2509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-2509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-2509
  • 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 8015-2509 available by request