V024-9839 Screening compound: 3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl ethane-1-sulfonate

V024-9839 Screening compound: 3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl ethane-1-sulfonate
V024-9839 Screening compound: 3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl ethane-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V024-9839
3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl ethane-1-sulfonate

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

V024-9839

Molecular Formula

C17H17NO6S2 (C17 H17 NO6 S2)

Compound Name

3-[5-(ethanesulfonyl)-1,3-benzoxazol-2-yl]phenyl ethane-1-sulfonate

IUPAC name

3-[5-(ethanesulfonyl)-13-benzoxazol-2-yl]phenyl ethane-1-sulfonate

SMILES

CCS(c(cc1)cc2c1oc(-c1cccc(OS(CC)(=O)=O)c1)n2)(=O)=O

InChI

InChI=1S/C17H17NO6S2/c1-3-25(19,20)14-8-9-16-15(11-14)18-17(23-16)12-6-5-7-13(10-12)24-26(21,22)4-2/h5-11H,3-4H2,1-2H3

InChI Key

AQMLPMISSJWXBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19794896

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.326

Distribution Coefficient, logD

2.326

Water Solubility, LogSw

-2.71

Polar Surface Area

81.194

Acid Dissociation Constant (pKa)

21.23

Base Dissociation Constant (pKb)

0.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

References: we are preparing a list of scientific research reports with V024-9839 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V024-9839?
Check Price and Availability of V024-9839, 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 V024-9839 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V024-9839
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V024-9839
  • 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 V024-9839 available by request