5107-0118 Screening compound: 4-[(1E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)diazen-1-yl]benzoic acid

5107-0118 Screening compound: 4-[(1E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)diazen-1-yl]benzoic acid
5107-0118 Screening compound: 4-[(1E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)diazen-1-yl]benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 5107-0118
4-[(1E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)diazen-1-yl]benzoic acid

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

5107-0118

Molecular Formula

C12H11N3O3 (C12 H11 N3 O3)

Compound Name

4-[(1E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)diazen-1-yl]benzoic acid

IUPAC name

4-[(1E)-2-(35-dimethyl-12-oxazol-4-yl)diazen-1-yl]benzoic acid

SMILES

Cc1noc(C)c1/N=N/c(cc1)ccc1C(O)=O

InChI

InChI=1S/C12H11N3O3/c1-7-11(8(2)18-15-7)14-13-10-5-3-9(4-6-10)12(16)17/h3-6H,1-2H3,(H,16,17)

InChI Key

OURHBHSLVNVZAM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03043406

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

245.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.118

Distribution Coefficient, logD

-0.272

Water Solubility, LogSw

-2.99

Polar Surface Area

70.976

Acid Dissociation Constant (pKa)

4.01

Base Dissociation Constant (pKb)

-2.77

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with 5107-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5107-0118?
Check Price and Availability of 5107-0118, 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 5107-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5107-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5107-0118
  • 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 5107-0118 available by request