8010-3369 Screening compound: (1-isopropyl-1H-1,3-benzimidazol-2-yl)(3-methoxyphenyl)methanol

8010-3369 Screening compound: (1-isopropyl-1H-1,3-benzimidazol-2-yl)(3-methoxyphenyl)methanol
8010-3369 Screening compound: (1-isopropyl-1H-1,3-benzimidazol-2-yl)(3-methoxyphenyl)methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-3369
(1-isopropyl-1H-1,3-benzimidazol-2-yl)(3-methoxyphenyl)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

8010-3369

Molecular Formula

C18H20N2O2 (C18 H20 N2 O2)

Compound Name

(1-isopropyl-1H-1,3-benzimidazol-2-yl)(3-methoxyphenyl)methanol

IUPAC name

(3-methoxyphenyl)[1-(propan-2-yl)-1H-13-benzodiazol-2-yl]methanol

SMILES

CC(C)n1c(cccc2)c2nc1C(c1cccc(OC)c1)O

InChI

InChI=1S/C18H20N2O2/c1-12(2)20-16-10-5-4-9-15(16)19-18(20)17(21)13-7-6-8-14(11-13)22-3/h4-12,17,21H,1-3H3/t17-/m1/s1

InChI Key

VGVXZFNDIGNHSS-QGZVFWFLSA-N

MDL Number (MFCD)

MFCD01871825

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

296.37

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.591

Distribution Coefficient, logD

3.591

Water Solubility, LogSw

-3.60

Polar Surface Area

34.471

Acid Dissociation Constant (pKa)

14.03

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.78

8010-3369 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Neuropeptide S Library (2850 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8010-3369 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-3369?
Check Price and Availability of 8010-3369, 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 8010-3369 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-3369
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-3369
  • 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 8010-3369 available by request