8013-3465 Screening compound: (1-isobutyl-1H-1,3-benzimidazol-2-yl)methyl phenyl ether

8013-3465 Screening compound: (1-isobutyl-1H-1,3-benzimidazol-2-yl)methyl phenyl ether
8013-3465 Screening compound: (1-isobutyl-1H-1,3-benzimidazol-2-yl)methyl phenyl ether alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-3465
(1-isobutyl-1H-1,3-benzimidazol-2-yl)methyl phenyl ether

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

8013-3465

Molecular Formula

C18H20N2O (C18 H20 N2 O)

Compound Name

(1-isobutyl-1H-1,3-benzimidazol-2-yl)methyl phenyl ether

IUPAC name

1-(2-methylpropyl)-2-(phenoxymethyl)-1H-13-benzodiazole

SMILES

CC(C)Cn1c(cccc2)c2nc1COc1ccccc1

InChI

InChI=1S/C18H20N2O/c1-14(2)12-20-17-11-7-6-10-16(17)19-18(20)13-21-15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3

InChI Key

LBMMQJIHRAYOJU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02630610

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.37

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.662

Distribution Coefficient, logD

4.662

Water Solubility, LogSw

-4.41

Polar Surface Area

18.642

Acid Dissociation Constant (pKa)

24.74

Base Dissociation Constant (pKb)

2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.78

References: we are preparing a list of scientific research reports with 8013-3465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-3465?
Check Price and Availability of 8013-3465, 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 8013-3465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-3465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-3465
  • 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 8013-3465 available by request