3201-0465 Screening compound: 4-[4,5-bis(3,4-dimethylphenyl)-1H-imidazol-2-yl]-2,6-di-tert-butylphenol

3201-0465 Screening compound: 4-[4,5-bis(3,4-dimethylphenyl)-1H-imidazol-2-yl]-2,6-di-tert-butylphenol
3201-0465 Screening compound: 4-[4,5-bis(3,4-dimethylphenyl)-1H-imidazol-2-yl]-2,6-di-tert-butylphenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3201-0465
4-[4,5-bis(3,4-dimethylphenyl)-1H-imidazol-2-yl]-2,6-di-tert-butylphenol

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

3201-0465

Molecular Formula

C33H40N2O (C33 H40 N2 O)

Compound Name

4-[4,5-bis(3,4-dimethylphenyl)-1H-imidazol-2-yl]-2,6-di-tert-butylphenol

IUPAC name

4-[45-bis(34-dimethylphenyl)-1H-imidazol-2-yl]-26-di-tert-butylphenol

SMILES

CC(C)(C)c1cc(-c2nc(-c3cc(C)c(C)cc3)c(-c3cc(C)c(C)cc3)[nH]2)cc(C(C)(C)C)c1O

InChI

InChI=1S/C33H40N2O/c1-19-11-13-23(15-21(19)3)28-29(24-14-12-20(2)22(4)16-24)35-31(34-28)25-17-26(32(5,6)7)30(36)27(18-25)33(8,9)10/h11-18,36H,1-10H3,(H,34,35)

InChI Key

RNUGMWOSGHODAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02009192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.69

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

10.114

Distribution Coefficient, logD

10.113

Water Solubility, LogSw

-6.00

Polar Surface Area

36.033

Acid Dissociation Constant (pKa)

10.36

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

3201-0465 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with 3201-0465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3201-0465?
Check Price and Availability of 3201-0465, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 3201-0465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3201-0465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3201-0465
  • 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 3201-0465 available by request