D283-0054 Screening compound: N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide

D283-0054 Screening compound: N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide
D283-0054 Screening compound: N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D283-0054
N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide

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

D283-0054

Molecular Formula

C19H21N5O4S (C19 H21 N5 O4 S)

Compound Name

N-{2-[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]ethyl}-4-(1H-1,2,3,4-tetrazol-1-yl)benzene-1-sulfonamide

IUPAC name

N-{2-[(22-dimethyl-23-dihydro-1-benzofuran-7-yl)oxy]ethyl}-4-(1H-1234-tetrazol-1-yl)benzene-1-sulfonamide

SMILES

CC(C)(Cc1ccc2)Oc1c2OCCNS(c(cc1)ccc1-n1nnnc1)(=O)=O

InChI

InChI=1S/C19H21N5O4S/c1-19(2)12-14-4-3-5-17(18(14)28-19)27-11-10-21-29(25,26)16-8-6-15(7-9-16)24-13-20-22-23-24/h3-9,13,21H,10-12H2,1-2H3

InChI Key

CMTOALNUYNWBAR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14816692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.47

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.116

Distribution Coefficient, logD

3.116

Water Solubility, LogSw

-3.53

Polar Surface Area

95.491

Acid Dissociation Constant (pKa)

10.87

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.60

D283-0054 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

RAR (Nuclear receptors) Ligands Library (6524 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D283-0054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D283-0054?
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What is the minimum amount of D283-0054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D283-0054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D283-0054
  • 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 D283-0054 available by request