D403-0593 Screening compound: 1-{4-[4-(4-methylbenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]piperazin-1-yl}propan-1-one

D403-0593 Screening compound: 1-{4-[4-(4-methylbenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]piperazin-1-yl}propan-1-one
D403-0593 Screening compound: 1-{4-[4-(4-methylbenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]piperazin-1-yl}propan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D403-0593
1-{4-[4-(4-methylbenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]piperazin-1-yl}propan-1-one

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

D403-0593

Molecular Formula

C23H25N3O4S (C23 H25 N3 O4 S)

Compound Name

1-{4-[4-(4-methylbenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]piperazin-1-yl}propan-1-one

IUPAC name

1-{4-[4-(4-methylbenzenesulfonyl)-2-phenyl-13-oxazol-5-yl]piperazin-1-yl}propan-1-one

SMILES

CCC(N(CC1)CCN1c(oc(-c1ccccc1)n1)c1S(c1ccc(C)cc1)(=O)=O)=O

InChI

InChI=1S/C23H25N3O4S/c1-3-20(27)25-13-15-26(16-14-25)23-22(24-21(30-23)18-7-5-4-6-8-18)31(28,29)19-11-9-17(2)10-12-19/h4-12H,3,13-16H2,1-2H3

InChI Key

SAFLBIYPCIRQCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27584394

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.952

Distribution Coefficient, logD

3.952

Water Solubility, LogSw

-3.79

Polar Surface Area

67.679

Acid Dissociation Constant (pKa)

24.10

Base Dissociation Constant (pKb)

-1.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.40

D403-0593 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 D403-0593 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D403-0593?
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What is the minimum amount of D403-0593 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D403-0593
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D403-0593
  • 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 D403-0593 available by request