3312-0075 Screening compound: 4-ALLYL-4H-[1,2,4]TRIAZOLO[1,5-A][1,3]BENZIMIDAZOLE

3312-0075 Screening compound: 4-ALLYL-4H-[1,2,4]TRIAZOLO[1,5-A][1,3]BENZIMIDAZOLE
3312-0075 Screening compound: 4-ALLYL-4H-[1,2,4]TRIAZOLO[1,5-A][1,3]BENZIMIDAZOLE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3312-0075
4-ALLYL-4H-[1,2,4]TRIAZOLO[1,5-A][1,3]BENZIMIDAZOLE

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

3312-0075

Molecular Formula

C11H10N4 (C11 H10 N4)

Compound Name

4-ALLYL-4H-[1,2,4]TRIAZOLO[1,5-A][1,3]BENZIMIDAZOLE

IUPAC name

n/a

SMILES

C=CCn1c2ncnn2c2c1cccc2

InChI

InChI=1S/C11H10N4/c1-2-7-14-9-5-3-4-6-10(9)15-11(14)12-8-13-15/h2-6,8H,1,7H2

InChI Key

SBWHVXZELBKDQL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00839721

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

198.23

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.841

Distribution Coefficient, logD

1.227

Water Solubility, LogSw

-1.43

Polar Surface Area

25.023

Acid Dissociation Constant (pKa)

26.96

Base Dissociation Constant (pKb)

7.89

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

1.00

3312-0075 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3312-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3312-0075?
Check Price and Availability of 3312-0075, 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 3312-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3312-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3312-0075
  • 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 3312-0075 available by request