3165-0034 Screening compound: 4-(2,2-dimethyl-6-{[4-(2-methylpropoxy)phenyl]methoxy}-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl)-2,2-dimethyl-1,3-dioxolane

3165-0034 Screening compound: 4-(2,2-dimethyl-6-{[4-(2-methylpropoxy)phenyl]methoxy}-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl)-2,2-dimethyl-1,3-dioxolane
3165-0034 Screening compound: 4-(2,2-dimethyl-6-{[4-(2-methylpropoxy)phenyl]methoxy}-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl)-2,2-dimethyl-1,3-dioxolane alternative view

Chemical Structure Depiction of ChemDiv screening compound 3165-0034
4-(2,2-dimethyl-6-{[4-(2-methylpropoxy)phenyl]methoxy}-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl)-2,2-dimethyl-1,3-dioxolane

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

3165-0034

Molecular Formula

C23H34O7 (C23 H34 O7)

Compound Name

4-(2,2-dimethyl-6-{[4-(2-methylpropoxy)phenyl]methoxy}-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl)-2,2-dimethyl-1,3-dioxolane

IUPAC name

4-(22-dimethyl-6-{[4-(2-methylpropoxy)phenyl]methoxy}-tetrahydro-2H-furo[23-d][13]dioxol-5-yl)-22-dimethyl-13-dioxolane

SMILES

CC(C)COc1ccc(COC2C3OC(C)(C)OC3OC2C2OC(C)(C)OC2)cc1

InChI

InChI=1S/C23H34O7/c1-14(2)11-24-16-9-7-15(8-10-16)12-25-19-18(17-13-26-22(3,4)28-17)27-21-20(19)29-23(5,6)30-21/h7-10,14,17-21H,11-13H2,1-6H3

InChI Key

HEBXIQDRIXAYPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02641765

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.514

Distribution Coefficient, logD

4.514

Water Solubility, LogSw

-4.42

Polar Surface Area

53.917

Acid Dissociation Constant (pKa)

25.13

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

5.00

Percent sp3 carbon bonding

73.90

3165-0034 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3165-0034 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of 3165-0034 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3165-0034
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Delivery formats for 3165-0034
  • 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 3165-0034 available by request