3093-0075 Screening compound: 2,6-di-tert-butyl-4-[2-(2-hydroxyphenyl)-5,6-dimethoxy-1H-1,3-benzodiazol-1-yl]phenol

3093-0075 Screening compound: 2,6-di-tert-butyl-4-[2-(2-hydroxyphenyl)-5,6-dimethoxy-1H-1,3-benzodiazol-1-yl]phenol
3093-0075 Screening compound: 2,6-di-tert-butyl-4-[2-(2-hydroxyphenyl)-5,6-dimethoxy-1H-1,3-benzodiazol-1-yl]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3093-0075
2,6-di-tert-butyl-4-[2-(2-hydroxyphenyl)-5,6-dimethoxy-1H-1,3-benzodiazol-1-yl]phenol

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

3093-0075

Molecular Formula

C29H34N2O4 (C29 H34 N2 O4)

Compound Name

2,6-di-tert-butyl-4-[2-(2-hydroxyphenyl)-5,6-dimethoxy-1H-1,3-benzodiazol-1-yl]phenol

IUPAC name

26-di-tert-butyl-4-[2-(2-hydroxyphenyl)-56-dimethoxy-1H-13-benzodiazol-1-yl]phenol

SMILES

CC(C)(C)c1cc(-n(c2c3)c(-c(cccc4)c4O)nc2cc(OC)c3OC)cc(C(C)(C)C)c1O

InChI

InChI=1S/C29H34N2O4/c1-28(2,3)19-13-17(14-20(26(19)33)29(4,5)6)31-22-16-25(35-8)24(34-7)15-21(22)30-27(31)18-11-9-10-12-23(18)32/h9-16,32-33H,1-8H3

InChI Key

XAUOSBWNCMQHKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01819943

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.953

Distribution Coefficient, logD

5.636

Water Solubility, LogSw

-5.63

Polar Surface Area

57.927

Acid Dissociation Constant (pKa)

9.32

Base Dissociation Constant (pKb)

8.70

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.50

References: we are preparing a list of scientific research reports with 3093-0075 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3093-0075?
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What is the minimum amount of 3093-0075 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3093-0075
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3093-0075
  • 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 3093-0075 available by request