8016-9300 Screening compound: 2-{4-[2-(2-fluorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]phenoxy}acetic acid

8016-9300 Screening compound: 2-{4-[2-(2-fluorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]phenoxy}acetic acid
8016-9300 Screening compound: 2-{4-[2-(2-fluorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]phenoxy}acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-9300
2-{4-[2-(2-fluorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]phenoxy}acetic acid

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

8016-9300

Molecular Formula

C16H13FN4O3 (C16 H13 FN4 O3)

Compound Name

2-{4-[2-(2-fluorobenzyl)-2H-1,2,3,4-tetraazol-5-yl]phenoxy}acetic acid

IUPAC name

2-(4-{2-[(2-fluorophenyl)methyl]-2H-1234-tetrazol-5-yl}phenoxy)acetic acid

SMILES

OC(COc(cc1)ccc1-c1nn(Cc(cccc2)c2F)nn1)=O

InChI

InChI=1S/C16H13FN4O3/c17-14-4-2-1-3-12(14)9-21-19-16(18-20-21)11-5-7-13(8-6-11)24-10-15(22)23/h1-8H,9-10H2,(H,22,23)

InChI Key

FVUVWCPUGSJHAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05860375

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

328.3

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.779

Distribution Coefficient, logD

-1.458

Water Solubility, LogSw

-3.04

Polar Surface Area

74.225

Acid Dissociation Constant (pKa)

3.16

Base Dissociation Constant (pKb)

-4.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8016-9300 in Drug Discovery

Included in Screening Libraries

Human Transcription Factors Annotated Library (5098 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 8016-9300 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-9300?
Check Price and Availability of 8016-9300, 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 8016-9300 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-9300
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-9300
  • 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 8016-9300 available by request