8018-0734 Screening compound: N~2~-[2-methoxy-4-(1H-1,2,3,4-tetraazol-1-yl)phenyl]-2-thiophenecarboxamide

8018-0734 Screening compound: N~2~-[2-methoxy-4-(1H-1,2,3,4-tetraazol-1-yl)phenyl]-2-thiophenecarboxamide
8018-0734 Screening compound: N~2~-[2-methoxy-4-(1H-1,2,3,4-tetraazol-1-yl)phenyl]-2-thiophenecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-0734
N~2~-[2-methoxy-4-(1H-1,2,3,4-tetraazol-1-yl)phenyl]-2-thiophenecarboxamide

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

8018-0734

Molecular Formula

C13H11N5O2S (C13 H11 N5 O2 S)

Compound Name

N~2~-[2-methoxy-4-(1H-1,2,3,4-tetraazol-1-yl)phenyl]-2-thiophenecarboxamide

IUPAC name

N-[2-methoxy-4-(1H-1234-tetrazol-1-yl)phenyl]thiophene-2-carboxamide

SMILES

COc(cc(cc1)-n2nnnc2)c1NC(c1cccs1)=O

InChI

InChI=1S/C13H11N5O2S/c1-20-11-7-9(18-8-14-16-17-18)4-5-10(11)15-13(19)12-3-2-6-21-12/h2-8H,1H3,(H,15,19)

InChI Key

DKWQTEVAYKTJIX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07022338

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

301.33

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.241

Distribution Coefficient, logD

2.241

Water Solubility, LogSw

-3.09

Polar Surface Area

71.046

Acid Dissociation Constant (pKa)

10.53

Base Dissociation Constant (pKb)

1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.69

8018-0734 in Drug Discovery

Included in Screening Libraries

RAR (Nuclear receptors) Ligands Library (6524 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8018-0734 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-0734?
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What is the minimum amount of 8018-0734 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-0734
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-0734
  • 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 8018-0734 available by request