8017-9611 Screening compound: 2-(1H-1,2,3,4-tetraazol-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-2H-1,2,3,4-tetraazole

8017-9611 Screening compound: 2-(1H-1,2,3,4-tetraazol-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-2H-1,2,3,4-tetraazole
8017-9611 Screening compound: 2-(1H-1,2,3,4-tetraazol-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-2H-1,2,3,4-tetraazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9611
2-(1H-1,2,3,4-tetraazol-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-2H-1,2,3,4-tetraazole

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

8017-9611

Molecular Formula

C10H7F3N8 (C10 H7 F3 N8)

Compound Name

2-(1H-1,2,3,4-tetraazol-5-ylmethyl)-5-[4-(trifluoromethyl)phenyl]-2H-1,2,3,4-tetraazole

IUPAC name

2-[(1H-1234-tetrazol-5-yl)methyl]-5-[4-(trifluoromethyl)phenyl]-2H-1234-tetrazole

SMILES

FC(c(cc1)ccc1-c1nn(Cc2nnn[nH]2)nn1)(F)F

InChI

InChI=1S/C10H7F3N8/c11-10(12,13)7-3-1-6(2-4-7)9-16-20-21(17-9)5-8-14-18-19-15-8/h1-4H,5H2,(H,14,15,18,19)

InChI Key

GVCYOLZARYQHFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06619510

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.21

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.686

Distribution Coefficient, logD

-0.369

Water Solubility, LogSw

-1.85

Polar Surface Area

89.717

Acid Dissociation Constant (pKa)

5.87

Base Dissociation Constant (pKb)

2.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8017-9611 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8017-9611 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9611?
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What is the minimum amount of 8017-9611 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9611
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9611
  • 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 8017-9611 available by request