K087-0106 Screening compound: 2-methylpropyl 4-({5-[(E)-{[(2-hydroxyphenyl)formamido]imino}methyl]-2-methoxyphenyl}methoxy)benzoate

K087-0106 Screening compound: 2-methylpropyl 4-({5-[(E)-{[(2-hydroxyphenyl)formamido]imino}methyl]-2-methoxyphenyl}methoxy)benzoate
K087-0106 Screening compound: 2-methylpropyl 4-({5-[(E)-{[(2-hydroxyphenyl)formamido]imino}methyl]-2-methoxyphenyl}methoxy)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K087-0106
2-methylpropyl 4-({5-[(E)-{[(2-hydroxyphenyl)formamido]imino}methyl]-2-methoxyphenyl}methoxy)benzoate

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

K087-0106

Molecular Formula

C27H28N2O6 (C27 H28 N2 O6)

Compound Name

2-methylpropyl 4-({5-[(E)-{[(2-hydroxyphenyl)formamido]imino}methyl]-2-methoxyphenyl}methoxy)benzoate

IUPAC name

2-methylpropyl 4-({5-[(E)-{[(2-hydroxyphenyl)formamido]imino}methyl]-2-methoxyphenyl}methoxy)benzoate

SMILES

CC(C)COC(c(cc1)ccc1OCc(cc(/C=N/NC(c(cccc1)c1O)=O)cc1)c1OC)=O

InChI

InChI=1S/C27H28N2O6/c1-18(2)16-35-27(32)20-9-11-22(12-10-20)34-17-21-14-19(8-13-25(21)33-3)15-28-29-26(31)23-6-4-5-7-24(23)30/h4-15,18,30H,16-17H2,1-3H3,(H,29,31)

InChI Key

SARMVBHAXCQKGZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01533457

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

476.53

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.867

Distribution Coefficient, logD

5.858

Water Solubility, LogSw

-5.38

Polar Surface Area

88.090

Acid Dissociation Constant (pKa)

9.06

Base Dissociation Constant (pKb)

-0.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with K087-0106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K087-0106?
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What is the minimum amount of K087-0106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K087-0106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K087-0106
  • 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 K087-0106 available by request