8206-0033 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-N-{2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethyl}acetamide

8206-0033 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-N-{2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethyl}acetamide
8206-0033 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-N-{2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8206-0033
N-[(3,4-dimethoxyphenyl)methyl]-N-{2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethyl}acetamide

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

8206-0033

Molecular Formula

C23H37NO4 (C23 H37 NO4)

Compound Name

N-[(3,4-dimethoxyphenyl)methyl]-N-{2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethyl}acetamide

IUPAC name

N-[(34-dimethoxyphenyl)methyl]-N-{2-[22-dimethyl-4-(propan-2-yl)oxan-4-yl]ethyl}acetamide

SMILES

CC(C)C1(CCN(Cc(cc2)cc(OC)c2OC)C(C)=O)CC(C)(C)OCC1

InChI

InChI=1S/C23H37NO4/c1-17(2)23(11-13-28-22(4,5)16-23)10-12-24(18(3)25)15-19-8-9-20(26-6)21(14-19)27-7/h8-9,14,17H,10-13,15-16H2,1-7H3/t23-/m0/s1

InChI Key

YLLVUYCHRPRTOE-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD03853029

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

391.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.532

Distribution Coefficient, logD

3.532

Water Solubility, LogSw

-3.52

Polar Surface Area

39.548

Acid Dissociation Constant (pKa)

24.05

Base Dissociation Constant (pKb)

-0.09

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

69.60

8206-0033 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 8206-0033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8206-0033?
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What is the minimum amount of 8206-0033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8206-0033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8206-0033
  • 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 8206-0033 available by request