0986-0220 Screening compound: 1-[(E)-[(4-{4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]benzenesulfonyl}phenyl)imino]methyl]naphthalen-2-ol

0986-0220 Screening compound: 1-[(E)-[(4-{4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]benzenesulfonyl}phenyl)imino]methyl]naphthalen-2-ol
0986-0220 Screening compound: 1-[(E)-[(4-{4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]benzenesulfonyl}phenyl)imino]methyl]naphthalen-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 0986-0220
1-[(E)-[(4-{4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]benzenesulfonyl}phenyl)imino]methyl]naphthalen-2-ol

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

0986-0220

Molecular Formula

C34H24N2O4S (C34 H24 N2 O4 S)

Compound Name

1-[(E)-[(4-{4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]benzenesulfonyl}phenyl)imino]methyl]naphthalen-2-ol

IUPAC name

1-[(E)-[(4-{4-[(E)-[(2-hydroxynaphthalen-1-yl)methylidene]amino]benzenesulfonyl}phenyl)imino]methyl]naphthalen-2-ol

SMILES

Oc1c(/C=N/c(cc2)ccc2S(c(cc2)ccc2/N=C/c(c2ccccc2cc2)c2O)(=O)=O)c2ccccc2cc1

InChI

InChI=1S/C34H24N2O4S/c37-33-19-9-23-5-1-3-7-29(23)31(33)21-35-25-11-15-27(16-12-25)41(39,40)28-17-13-26(14-18-28)36-22-32-30-8-4-2-6-24(30)10-20-34(32)38/h1-22,37-38H

InChI Key

KVRFEHSUTMNNRW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00089341

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

556.64

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

7.114

Distribution Coefficient, logD

7.069

Water Solubility, LogSw

-7.03

Polar Surface Area

78.547

Acid Dissociation Constant (pKa)

8.37

Base Dissociation Constant (pKb)

2.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0986-0220 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 0986-0220 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0986-0220?
Check Price and Availability of 0986-0220, 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 0986-0220 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0986-0220
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0986-0220
  • 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 0986-0220 available by request