0987-0130 Screening compound: 2'-(acetyloxy)-[1,1'-binaphthalen]-2-yl acetate

0987-0130 Screening compound: 2'-(acetyloxy)-[1,1'-binaphthalen]-2-yl acetate
0987-0130 Screening compound: 2'-(acetyloxy)-[1,1'-binaphthalen]-2-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0987-0130
2'-(acetyloxy)-[1,1'-binaphthalen]-2-yl acetate

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

0987-0130

Molecular Formula

C24H18O4 (C24 H18 O4)

Compound Name

2'-(acetyloxy)-[1,1'-binaphthalen]-2-yl acetate

IUPAC name

2'-(acetyloxy)-[11'-binaphthalen]-2-yl acetate

SMILES

CC(Oc(ccc1ccccc11)c1-c(c1ccccc1cc1)c1OC(C)=O)=O

InChI

InChI=1S/C24H18O4/c1-15(25)27-21-13-11-17-7-3-5-9-19(17)23(21)24-20-10-6-4-8-18(20)12-14-22(24)28-16(2)26/h3-14H,1-2H3

InChI Key

ATCPATYOODPQCO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00691542

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.4

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.680

Distribution Coefficient, logD

4.680

Water Solubility, LogSw

-5.59

Polar Surface Area

41.099

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

0987-0130 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Frequent Hitters Library (7624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0987-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0987-0130?
Check Price and Availability of 0987-0130, 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 0987-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0987-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0987-0130
  • 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 0987-0130 available by request