K220-13853 Screening compound: 4-{[(2Z)-6-methoxy-3-[(4-methoxyphenyl)carbamoyl]-2H-chromen-2-ylidene]amino}benzoic acid

K220-13853 Screening compound: 4-{[(2Z)-6-methoxy-3-[(4-methoxyphenyl)carbamoyl]-2H-chromen-2-ylidene]amino}benzoic acid
K220-13853 Screening compound: 4-{[(2Z)-6-methoxy-3-[(4-methoxyphenyl)carbamoyl]-2H-chromen-2-ylidene]amino}benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound K220-13853
4-{[(2Z)-6-methoxy-3-[(4-methoxyphenyl)carbamoyl]-2H-chromen-2-ylidene]amino}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

K220-13853

Molecular Formula

C25H20N2O6 (C25 H20 N2 O6)

Compound Name

4-{[(2Z)-6-methoxy-3-[(4-methoxyphenyl)carbamoyl]-2H-chromen-2-ylidene]amino}benzoic acid

IUPAC name

4-{[(2Z)-6-methoxy-3-[(4-methoxyphenyl)carbamoyl]-2H-chromen-2-ylidene]amino}benzoic acid

SMILES

COc(cc1)ccc1NC(C1=Cc(cc(cc2)OC)c2O/C1=N\c(cc1)ccc1C(O)=O)=O

InChI

InChI=1S/C25H20N2O6/c1-31-19-9-7-17(8-10-19)26-23(28)21-14-16-13-20(32-2)11-12-22(16)33-24(21)27-18-5-3-15(4-6-18)25(29)30/h3-14H,1-2H3,(H,26,28)(H,29,30)

InChI Key

AXWAQRUCHMQNKY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081820

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444.44

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.263

Distribution Coefficient, logD

0.873

Water Solubility, LogSw

-4.46

Polar Surface Area

82.532

Acid Dissociation Constant (pKa)

4.01

Base Dissociation Constant (pKb)

0.63

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.00

References: we are preparing a list of scientific research reports with K220-13853 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K220-13853?
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What is the minimum amount of K220-13853 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K220-13853
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K220-13853
  • 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 K220-13853 available by request