V004-1026 Screening compound: 2-(1,3-benzoxazol-2-yl)-5-chlorophenyl 2-methoxybenzene-1-sulfonate

V004-1026 Screening compound: 2-(1,3-benzoxazol-2-yl)-5-chlorophenyl 2-methoxybenzene-1-sulfonate
V004-1026 Screening compound: 2-(1,3-benzoxazol-2-yl)-5-chlorophenyl 2-methoxybenzene-1-sulfonate alternative view

Chemical Structure Depiction of ChemDiv screening compound V004-1026
2-(1,3-benzoxazol-2-yl)-5-chlorophenyl 2-methoxybenzene-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

V004-1026

Molecular Formula

C20H14ClNO5S (C20 H14 ClNO5 S)

Compound Name

2-(1,3-benzoxazol-2-yl)-5-chlorophenyl 2-methoxybenzene-1-sulfonate

IUPAC name

2-(13-benzoxazol-2-yl)-5-chlorophenyl 2-methoxybenzene-1-sulfonate

SMILES

COc(cccc1)c1S(Oc(cc(cc1)Cl)c1-c1nc(cccc2)c2o1)(=O)=O

InChI

InChI=1S/C20H14ClNO5S/c1-25-17-8-4-5-9-19(17)28(23,24)27-18-12-13(21)10-11-14(18)20-22-15-6-2-3-7-16(15)26-20/h2-12H,1H3

InChI Key

PZHXSGWCJLGQBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791081

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.85

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.080

Distribution Coefficient, logD

5.080

Water Solubility, LogSw

-5.23

Polar Surface Area

60.527

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

-2.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with V004-1026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V004-1026?
Check Price and Availability of V004-1026, 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 V004-1026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V004-1026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V004-1026
  • 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 V004-1026 available by request