6738-0050 Screening compound: 1-[2-imino-3-(2-piperidinoethyl)-2,3-dihydro-1H-1,3-benzimidazol-1-yl]-3-(2-methoxyphenoxy)-2-propanol

6738-0050 Screening compound: 1-[2-imino-3-(2-piperidinoethyl)-2,3-dihydro-1H-1,3-benzimidazol-1-yl]-3-(2-methoxyphenoxy)-2-propanol
6738-0050 Screening compound: 1-[2-imino-3-(2-piperidinoethyl)-2,3-dihydro-1H-1,3-benzimidazol-1-yl]-3-(2-methoxyphenoxy)-2-propanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 6738-0050
1-[2-imino-3-(2-piperidinoethyl)-2,3-dihydro-1H-1,3-benzimidazol-1-yl]-3-(2-methoxyphenoxy)-2-propanol

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

6738-0050

Molecular Formula

C24H32N4O3 (C24 H32 N4 O3)

Compound Name

1-[2-imino-3-(2-piperidinoethyl)-2,3-dihydro-1H-1,3-benzimidazol-1-yl]-3-(2-methoxyphenoxy)-2-propanol

IUPAC name

n/a

SMILES

COc(cccc1)c1OCC(CN(c(cccc1)c1N1CCN2CCCCC2)C1=N)O

InChI

InChI=1S/C24H32N4O3/c1-30-22-11-5-6-12-23(22)31-18-19(29)17-28-21-10-4-3-9-20(21)27(24(28)25)16-15-26-13-7-2-8-14-26/h3-6,9-12,19,25,29H,2,7-8,13-18H2,1H3/t19-/m0/s1

InChI Key

WBUOOXNMVHIUJT-IBGZPJMESA-N

MDL Number (MFCD)

MFCD04020758

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

424.54

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.369

Distribution Coefficient, logD

0.824

Water Solubility, LogSw

-3.47

Polar Surface Area

57.379

Acid Dissociation Constant (pKa)

16.48

Base Dissociation Constant (pKb)

9.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.80

References: we are preparing a list of scientific research reports with 6738-0050 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6738-0050?
Check Price and Availability of 6738-0050, 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 6738-0050 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6738-0050
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6738-0050
  • 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 6738-0050 available by request