D516-0243 Screening compound: 2-methoxy-N-(2-{1-methyl-5-[2-(2-methylphenoxy)acetamido]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide

D516-0243 Screening compound: 2-methoxy-N-(2-{1-methyl-5-[2-(2-methylphenoxy)acetamido]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide
D516-0243 Screening compound: 2-methoxy-N-(2-{1-methyl-5-[2-(2-methylphenoxy)acetamido]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D516-0243
2-methoxy-N-(2-{1-methyl-5-[2-(2-methylphenoxy)acetamido]-1H-1,3-benzodiazol-2-yl}ethyl)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

D516-0243

Molecular Formula

C27H28N4O4 (C27 H28 N4 O4)

Compound Name

2-methoxy-N-(2-{1-methyl-5-[2-(2-methylphenoxy)acetamido]-1H-1,3-benzodiazol-2-yl}ethyl)benzamide

IUPAC name

2-methoxy-N-(2-{1-methyl-5-[2-(2-methylphenoxy)acetamido]-1H-13-benzodiazol-2-yl}ethyl)benzamide

SMILES

Cc(cccc1)c1OCC(Nc(cc1)cc2c1n(C)c(CCNC(c(cccc1)c1OC)=O)n2)=O

InChI

InChI=1S/C27H28N4O4/c1-18-8-4-6-10-23(18)35-17-26(32)29-19-12-13-22-21(16-19)30-25(31(22)2)14-15-28-27(33)20-9-5-7-11-24(20)34-3/h4-13,16H,14-15,17H2,1-3H3,(H,28,33)(H,29,32)

InChI Key

FOMKUHJMGXSFIR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

472.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.051

Distribution Coefficient, logD

4.046

Water Solubility, LogSw

-4.30

Polar Surface Area

74.574

Acid Dissociation Constant (pKa)

11.92

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

References: we are preparing a list of scientific research reports with D516-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D516-0243?
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What is the minimum amount of D516-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D516-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D516-0243
  • 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 D516-0243 available by request