1763-0002 Screening compound: 1-[4-(1H-1,2,3-benzotriazole-1-carbonyl)benzoyl]-1H-1,2,3-benzotriazole

1763-0002 Screening compound: 1-[4-(1H-1,2,3-benzotriazole-1-carbonyl)benzoyl]-1H-1,2,3-benzotriazole
1763-0002 Screening compound: 1-[4-(1H-1,2,3-benzotriazole-1-carbonyl)benzoyl]-1H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 1763-0002
1-[4-(1H-1,2,3-benzotriazole-1-carbonyl)benzoyl]-1H-1,2,3-benzotriazole

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

1763-0002

Molecular Formula

C20H12N6O2 (C20 H12 N6 O2)

Compound Name

1-[4-(1H-1,2,3-benzotriazole-1-carbonyl)benzoyl]-1H-1,2,3-benzotriazole

IUPAC name

1-[4-(1H-123-benzotriazole-1-carbonyl)benzoyl]-1H-123-benzotriazole

SMILES

O=C(c(cc1)ccc1C(n1nnc2c1cccc2)=O)n1nnc2c1cccc2

InChI

InChI=1S/C20H12N6O2/c27-19(25-17-7-3-1-5-15(17)21-23-25)13-9-11-14(12-10-13)20(28)26-18-8-4-2-6-16(18)22-24-26/h1-12H

InChI Key

PNENGEFVBQPWCZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00356292

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.35

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.056

Distribution Coefficient, logD

2.056

Water Solubility, LogSw

-2.25

Polar Surface Area

77.755

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1763-0002 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1763-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1763-0002?
Check Price and Availability of 1763-0002, 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 1763-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1763-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1763-0002
  • 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 1763-0002 available by request