1079-1337 Screening compound: 2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-1H-1,3-benzodiazole

1079-1337 Screening compound: 2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-1H-1,3-benzodiazole
1079-1337 Screening compound: 2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 1079-1337
2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-1H-1,3-benzodiazole

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

1079-1337

Molecular Formula

C9H8N6 (C9 H8 N6)

Compound Name

2-[(1H-1,2,3,4-tetrazol-5-yl)methyl]-1H-1,3-benzodiazole

IUPAC name

2-[(1H-1234-tetrazol-5-yl)methyl]-1H-13-benzodiazole

SMILES

C(c1nc(cccc2)c2[nH]1)c1nnn[nH]1

InChI

InChI=1S/C9H8N6/c1-2-4-7-6(3-1)10-8(11-7)5-9-12-14-15-13-9/h1-4H,5H2,(H,10,11)(H,12,13,14,15)

InChI Key

LUKGJSVGTMPFCN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00476489

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

200.2

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.222

Distribution Coefficient, logD

1.222

Water Solubility, LogSw

-1.25

Polar Surface Area

71.623

Acid Dissociation Constant (pKa)

5.59

Base Dissociation Constant (pKb)

4.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.11

References: we are preparing a list of scientific research reports with 1079-1337 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1079-1337?
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What is the minimum amount of 1079-1337 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1079-1337
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1079-1337
  • 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 1079-1337 available by request