8018-5724 Screening compound: 2-phenyl-4-(piperidinomethyl)-1H-1,3-benzimidazol-5-ol

8018-5724 Screening compound: 2-phenyl-4-(piperidinomethyl)-1H-1,3-benzimidazol-5-ol
8018-5724 Screening compound: 2-phenyl-4-(piperidinomethyl)-1H-1,3-benzimidazol-5-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5724
2-phenyl-4-(piperidinomethyl)-1H-1,3-benzimidazol-5-ol

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

8018-5724

Molecular Formula

C19H21N3O (C19 H21 N3 O)

Compound Name

2-phenyl-4-(piperidinomethyl)-1H-1,3-benzimidazol-5-ol

IUPAC name

2-phenyl-4-[(piperidin-1-yl)methyl]-1H-13-benzodiazol-5-ol

SMILES

Oc(cc1)c(CN2CCCCC2)c2c1[nH]c(-c1ccccc1)n2

InChI

InChI=1S/C19H21N3O/c23-17-10-9-16-18(15(17)13-22-11-5-2-6-12-22)21-19(20-16)14-7-3-1-4-8-14/h1,3-4,7-10,23H,2,5-6,11-13H2,(H,20,21)

InChI Key

FVHKIGHCUWTXCC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01088066

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

307.4

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.677

Distribution Coefficient, logD

2.962

Water Solubility, LogSw

-3.69

Polar Surface Area

40.309

Acid Dissociation Constant (pKa)

9.53

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.58

8018-5724 in Drug Discovery

Included in Screening Libraries

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

CNS Annotated Library (688 compounds)

Human Ion Channels Annotated Library (353 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8018-5724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5724?
Check Price and Availability of 8018-5724, 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 8018-5724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5724
  • 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 8018-5724 available by request