6665-0121 Screening compound: [1-(2-methylbutyl)-1H-1,3-benzodiazol-2-yl](phenyl)methanol

6665-0121 Screening compound: [1-(2-methylbutyl)-1H-1,3-benzodiazol-2-yl](phenyl)methanol
6665-0121 Screening compound: [1-(2-methylbutyl)-1H-1,3-benzodiazol-2-yl](phenyl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6665-0121
[1-(2-methylbutyl)-1H-1,3-benzodiazol-2-yl](phenyl)methanol

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

6665-0121

Molecular Formula

C19H22N2O (C19 H22 N2 O)

Compound Name

[1-(2-methylbutyl)-1H-1,3-benzodiazol-2-yl](phenyl)methanol

IUPAC name

[1-(2-methylbutyl)-1H-13-benzodiazol-2-yl](phenyl)methanol

SMILES

CCC(C)Cn1c(cccc2)c2nc1C(c1ccccc1)O

InChI

InChI=1S/C19H22N2O/c1-3-14(2)13-21-17-12-8-7-11-16(17)20-19(21)18(22)15-9-5-4-6-10-15/h4-12,14,18,22H,3,13H2,1-2H3

InChI Key

YWAMKZASYMAUEH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04218183

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.4

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.719

Distribution Coefficient, logD

4.719

Water Solubility, LogSw

-4.33

Polar Surface Area

25.852

Acid Dissociation Constant (pKa)

14.03

Base Dissociation Constant (pKb)

3.73

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

31.60

6665-0121 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6665-0121 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6665-0121?
Check Price and Availability of 6665-0121, 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 6665-0121 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6665-0121
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6665-0121
  • 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 6665-0121 available by request