D403-0058 Screening compound: 1-[4-(benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-(furan-2-carbonyl)piperazine

D403-0058 Screening compound: 1-[4-(benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-(furan-2-carbonyl)piperazine
D403-0058 Screening compound: 1-[4-(benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-(furan-2-carbonyl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D403-0058
1-[4-(benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-(furan-2-carbonyl)piperazine

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

D403-0058

Molecular Formula

C25H23N3O5S (C25 H23 N3 O5 S)

Compound Name

1-[4-(benzenesulfonyl)-2-(4-methylphenyl)-1,3-oxazol-5-yl]-4-(furan-2-carbonyl)piperazine

IUPAC name

1-[4-(benzenesulfonyl)-2-(4-methylphenyl)-13-oxazol-5-yl]-4-(furan-2-carbonyl)piperazine

SMILES

Cc(cc1)ccc1-c1nc(S(c2ccccc2)(=O)=O)c(N(CC2)CCN2C(c2ccco2)=O)o1

InChI

InChI=1S/C25H23N3O5S/c1-18-9-11-19(12-10-18)22-26-23(34(30,31)20-6-3-2-4-7-20)25(33-22)28-15-13-27(14-16-28)24(29)21-8-5-17-32-21/h2-12,17H,13-16H2,1H3

InChI Key

XFISGWCPAMRPOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27584372

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

477.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.077

Distribution Coefficient, logD

4.077

Water Solubility, LogSw

-4.10

Polar Surface Area

76.513

Acid Dissociation Constant (pKa)

27.44

Base Dissociation Constant (pKb)

-2.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

D403-0058 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D403-0058 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D403-0058?
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What is the minimum amount of D403-0058 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D403-0058
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D403-0058
  • 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 D403-0058 available by request