D541-0033 Screening compound: 3,5-dichloro-4-propoxy-N-[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide

D541-0033 Screening compound: 3,5-dichloro-4-propoxy-N-[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide
D541-0033 Screening compound: 3,5-dichloro-4-propoxy-N-[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D541-0033
3,5-dichloro-4-propoxy-N-[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide

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

D541-0033

Molecular Formula

C17H15Cl2N5O2 (C17 H15 Cl2 N5 O2)

Compound Name

3,5-dichloro-4-propoxy-N-[4-(1H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide

IUPAC name

35-dichloro-4-propoxy-N-[4-(1H-1234-tetrazol-1-yl)phenyl]benzamide

SMILES

CCCOc(c(Cl)cc(C(Nc(cc1)ccc1-n1nnnc1)=O)c1)c1Cl

InChI

InChI=1S/C17H15Cl2N5O2/c1-2-7-26-16-14(18)8-11(9-15(16)19)17(25)21-12-3-5-13(6-4-12)24-10-20-22-23-24/h3-6,8-10H,2,7H2,1H3,(H,21,25)

InChI Key

IGWSGVLYWLNLBG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833499

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.24

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.460

Distribution Coefficient, logD

4.457

Water Solubility, LogSw

-4.60

Polar Surface Area

70.686

Acid Dissociation Constant (pKa)

9.59

Base Dissociation Constant (pKb)

-2.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

D541-0033 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 D541-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D541-0033?
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What is the minimum amount of D541-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D541-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D541-0033
  • 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 D541-0033 available by request