D072-0093 Screening compound: 4-[4-(4-bromobenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine

D072-0093 Screening compound: 4-[4-(4-bromobenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine
D072-0093 Screening compound: 4-[4-(4-bromobenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound D072-0093
4-[4-(4-bromobenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine

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

D072-0093

Molecular Formula

C19H17BrN2O4S (C19 H17 BrN2 O4 S)

Compound Name

4-[4-(4-bromobenzenesulfonyl)-2-phenyl-1,3-oxazol-5-yl]morpholine

IUPAC name

4-[4-(4-bromobenzenesulfonyl)-2-phenyl-13-oxazol-5-yl]morpholine

SMILES

O=S(c1c(N2CCOCC2)oc(-c2ccccc2)n1)(c(cc1)ccc1Br)=O

InChI

InChI=1S/C19H17BrN2O4S/c20-15-6-8-16(9-7-15)27(23,24)18-19(22-10-12-25-13-11-22)26-17(21-18)14-4-2-1-3-5-14/h1-9H,10-13H2

InChI Key

JTXFKXWXYCDWOH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04515967

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.33

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.200

Distribution Coefficient, logD

4.200

Water Solubility, LogSw

-4.25

Polar Surface Area

59.387

Acid Dissociation Constant (pKa)

27.23

Base Dissociation Constant (pKb)

-7.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D072-0093 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 compounds)

PI3K-Targeted Library (17255 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D072-0093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D072-0093?
Check Price and Availability of D072-0093, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D072-0093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D072-0093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D072-0093
  • 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 D072-0093 available by request