0832-2661 Screening compound: 4'-[(E)-{[(3,5,7-trimethyladamantan-1-yl)methyl]imino}methyl]-[1,1'-biphenyl]-4-yl acetate

0832-2661 Screening compound: 4'-[(E)-{[(3,5,7-trimethyladamantan-1-yl)methyl]imino}methyl]-[1,1'-biphenyl]-4-yl acetate
0832-2661 Screening compound: 4'-[(E)-{[(3,5,7-trimethyladamantan-1-yl)methyl]imino}methyl]-[1,1'-biphenyl]-4-yl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0832-2661
4'-[(E)-{[(3,5,7-trimethyladamantan-1-yl)methyl]imino}methyl]-[1,1'-biphenyl]-4-yl 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

0832-2661

Molecular Formula

C29H35NO2 (C29 H35 NO2)

Compound Name

4'-[(E)-{[(3,5,7-trimethyladamantan-1-yl)methyl]imino}methyl]-[1,1'-biphenyl]-4-yl acetate

IUPAC name

4'-[(E)-{[(357-trimethyladamantan-1-yl)methyl]imino}methyl]-[11'-biphenyl]-4-yl acetate

SMILES

CC(C1)(C2)CC3(C/N=C/c(cc4)ccc4-c(cc4)ccc4OC(C)=O)CC2(C)CC1(C)C3

InChI

InChI=1S/C29H35NO2/c1-21(31)32-25-11-9-24(10-12-25)23-7-5-22(6-8-23)13-30-20-29-17-26(2)14-27(3,18-29)16-28(4,15-26)19-29/h5-13H,14-20H2,1-4H3

InChI Key

NBLYMHQBUHWIDW-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.6

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

6.956

Distribution Coefficient, logD

6.955

Water Solubility, LogSw

-5.91

Polar Surface Area

29.413

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

4.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

51.70

References: we are preparing a list of scientific research reports with 0832-2661 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0832-2661?
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What is the minimum amount of 0832-2661 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0832-2661
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0832-2661
  • 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 0832-2661 available by request