D400-7514 Screening compound: N-(4-ethylphenyl)-4-methoxy-3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]benzene-1-sulfonamide

D400-7514 Screening compound: N-(4-ethylphenyl)-4-methoxy-3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]benzene-1-sulfonamide
D400-7514 Screening compound: N-(4-ethylphenyl)-4-methoxy-3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]benzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D400-7514
N-(4-ethylphenyl)-4-methoxy-3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-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

D400-7514

Molecular Formula

C20H23N3O4S (C20 H23 N3 O4 S)

Compound Name

N-(4-ethylphenyl)-4-methoxy-3-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]benzene-1-sulfonamide

IUPAC name

N-(4-ethylphenyl)-4-methoxy-3-[3-(propan-2-yl)-124-oxadiazol-5-yl]benzene-1-sulfonamide

SMILES

CCc(cc1)ccc1NS(c(cc1)cc(-c2nc(C(C)C)no2)c1OC)(=O)=O

InChI

InChI=1S/C20H23N3O4S/c1-5-14-6-8-15(9-7-14)23-28(24,25)16-10-11-18(26-4)17(12-16)20-21-19(13(2)3)22-27-20/h6-13,23H,5H2,1-4H3

InChI Key

MTNBMVBPVUVQBS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27584155

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.852

Distribution Coefficient, logD

4.851

Water Solubility, LogSw

-4.61

Polar Surface Area

80.196

Acid Dissociation Constant (pKa)

9.81

Base Dissociation Constant (pKb)

-3.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

D400-7514 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D400-7514 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D400-7514?
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What is the minimum amount of D400-7514 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D400-7514
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D400-7514
  • 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 D400-7514 available by request