1688-0257 Screening compound: 3-[(E)-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino]-N-(naphthalen-1-yl)benzamide

1688-0257 Screening compound: 3-[(E)-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino]-N-(naphthalen-1-yl)benzamide
1688-0257 Screening compound: 3-[(E)-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino]-N-(naphthalen-1-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1688-0257
3-[(E)-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino]-N-(naphthalen-1-yl)benzamide

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

1688-0257

Molecular Formula

C25H19BrN2O3 (C25 H19 BrN2 O3)

Compound Name

3-[(E)-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino]-N-(naphthalen-1-yl)benzamide

IUPAC name

3-[(E)-[(5-bromo-2-hydroxy-3-methoxyphenyl)methylidene]amino]-N-(naphthalen-1-yl)benzamide

SMILES

COc(cc(cc1/C=N/c2cc(C(Nc3cccc4ccccc34)=O)ccc2)Br)c1O

InChI

InChI=1S/C25H19BrN2O3/c1-31-23-14-19(26)12-18(24(23)29)15-27-20-9-4-8-17(13-20)25(30)28-22-11-5-7-16-6-2-3-10-21(16)22/h2-15,29H,1H3,(H,28,30)

InChI Key

HNFGIXLDSXWFGB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01040291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

475.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.533

Distribution Coefficient, logD

5.411

Water Solubility, LogSw

-6.44

Polar Surface Area

53.597

Acid Dissociation Constant (pKa)

7.89

Base Dissociation Constant (pKb)

3.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

1688-0257 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 1688-0257 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1688-0257?
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What is the minimum amount of 1688-0257 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1688-0257
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1688-0257
  • 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 1688-0257 available by request