D072-1600 Screening compound: 2-(4-chlorophenyl)-N-cyclopropyl-4-(4-fluorobenzenesulfonyl)-1,3-oxazol-5-amine

D072-1600 Screening compound: 2-(4-chlorophenyl)-N-cyclopropyl-4-(4-fluorobenzenesulfonyl)-1,3-oxazol-5-amine
D072-1600 Screening compound: 2-(4-chlorophenyl)-N-cyclopropyl-4-(4-fluorobenzenesulfonyl)-1,3-oxazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound D072-1600
2-(4-chlorophenyl)-N-cyclopropyl-4-(4-fluorobenzenesulfonyl)-1,3-oxazol-5-amine

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

D072-1600

Molecular Formula

C18H14ClFN2O3S (C18 H14 ClFN2 O3 S)

Compound Name

2-(4-chlorophenyl)-N-cyclopropyl-4-(4-fluorobenzenesulfonyl)-1,3-oxazol-5-amine

IUPAC name

2-(4-chlorophenyl)-N-cyclopropyl-4-(4-fluorobenzenesulfonyl)-13-oxazol-5-amine

SMILES

O=S(c1c(NC2CC2)oc(-c(cc2)ccc2Cl)n1)(c(cc1)ccc1F)=O

InChI

InChI=1S/C18H14ClFN2O3S/c19-12-3-1-11(2-4-12)16-22-18(17(25-16)21-14-7-8-14)26(23,24)15-9-5-13(20)6-10-15/h1-6,9-10,14,21H,7-8H2

InChI Key

GJWRWFNWZOSCQA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04551907

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.84

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.467

Distribution Coefficient, logD

4.467

Water Solubility, LogSw

-4.78

Polar Surface Area

58.058

Acid Dissociation Constant (pKa)

17.52

Base Dissociation Constant (pKb)

-6.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

D072-1600 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Targeted Diversity Library (40567 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with D072-1600 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D072-1600?
Check Price and Availability of D072-1600, 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 D072-1600 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D072-1600
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D072-1600
  • 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 D072-1600 available by request