1348-1281 Screening compound: ethyl 2-{2-[(E)-({2-[2-methyl-5-(propan-2-yl)phenoxy]acetamido}imino)methyl]phenoxy}acetate

1348-1281 Screening compound: ethyl 2-{2-[(E)-({2-[2-methyl-5-(propan-2-yl)phenoxy]acetamido}imino)methyl]phenoxy}acetate
1348-1281 Screening compound: ethyl 2-{2-[(E)-({2-[2-methyl-5-(propan-2-yl)phenoxy]acetamido}imino)methyl]phenoxy}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 1348-1281
ethyl 2-{2-[(E)-({2-[2-methyl-5-(propan-2-yl)phenoxy]acetamido}imino)methyl]phenoxy}acetate

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

1348-1281

Molecular Formula

C23H28N2O5 (C23 H28 N2 O5)

Compound Name

ethyl 2-{2-[(E)-({2-[2-methyl-5-(propan-2-yl)phenoxy]acetamido}imino)methyl]phenoxy}acetate

IUPAC name

ethyl 2-{2-[(E)-({2-[2-methyl-5-(propan-2-yl)phenoxy]acetamido}imino)methyl]phenoxy}acetate

SMILES

CCOC(COc1c(/C=N/NC(COc2c(C)ccc(C(C)C)c2)=O)cccc1)=O

InChI

InChI=1S/C23H28N2O5/c1-5-28-23(27)15-30-20-9-7-6-8-19(20)13-24-25-22(26)14-29-21-12-18(16(2)3)11-10-17(21)4/h6-13,16H,5,14-15H2,1-4H3,(H,25,26)

InChI Key

ASLIVPYHPUSMRU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00683549

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.961

Distribution Coefficient, logD

4.961

Water Solubility, LogSw

-4.58

Polar Surface Area

70.671

Acid Dissociation Constant (pKa)

11.17

Base Dissociation Constant (pKb)

2.07

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

1348-1281 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 1348-1281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1348-1281?
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What is the minimum amount of 1348-1281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1348-1281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1348-1281
  • 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 1348-1281 available by request