8019-8637 Screening compound: 2-[5-(2H-1,3-benzodioxol-5-yl)-2H-1,2,3,4-tetrazol-2-yl]ethan-1-ol

8019-8637 Screening compound: 2-[5-(2H-1,3-benzodioxol-5-yl)-2H-1,2,3,4-tetrazol-2-yl]ethan-1-ol
8019-8637 Screening compound: 2-[5-(2H-1,3-benzodioxol-5-yl)-2H-1,2,3,4-tetrazol-2-yl]ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8637
2-[5-(2H-1,3-benzodioxol-5-yl)-2H-1,2,3,4-tetrazol-2-yl]ethan-1-ol

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

8019-8637

Molecular Formula

C10H10N4O3 (C10 H10 N4 O3)

Compound Name

2-[5-(2H-1,3-benzodioxol-5-yl)-2H-1,2,3,4-tetrazol-2-yl]ethan-1-ol

IUPAC name

2-[5-(2H-13-benzodioxol-5-yl)-2H-1234-tetrazol-2-yl]ethan-1-ol

SMILES

OCCn1nnc(-c(cc2)cc3c2OCO3)n1

InChI

InChI=1S/C10H10N4O3/c15-4-3-14-12-10(11-13-14)7-1-2-8-9(5-7)17-6-16-8/h1-2,5,15H,3-4,6H2

InChI Key

HNOPMNPNVUJNQV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09743346

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.21

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.923

Distribution Coefficient, logD

0.923

Water Solubility, LogSw

-1.46

Polar Surface Area

72.363

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

-2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

8019-8637 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 8019-8637 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8637?
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What is the minimum amount of 8019-8637 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8637
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8637
  • 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 8019-8637 available by request