3260-0393 Screening compound: 2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}ethan-1-ol

3260-0393 Screening compound: 2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}ethan-1-ol
3260-0393 Screening compound: 2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}ethan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 3260-0393
2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}ethan-1-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

3260-0393

Molecular Formula

C16H24N4O (C16 H24 N4 O)

Compound Name

2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-2,3-dihydro-1H-1,3-benzodiazol-1-yl}ethan-1-ol

IUPAC name

2-{2-imino-3-[2-(piperidin-1-yl)ethyl]-23-dihydro-1H-13-benzodiazol-1-yl}ethan-1-ol

SMILES

N=C1N(CCO)c(cccc2)c2N1CCN1CCCCC1

InChI

InChI=1S/C16H24N4O/c17-16-19(11-10-18-8-4-1-5-9-18)14-6-2-3-7-15(14)20(16)12-13-21/h2-3,6-7,17,21H,1,4-5,8-13H2

InChI Key

MJKQHDSLMAFJOR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01051262

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

288.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.553

Distribution Coefficient, logD

-0.992

Water Solubility, LogSw

-1.52

Polar Surface Area

42.449

Acid Dissociation Constant (pKa)

15.18

Base Dissociation Constant (pKb)

9.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

56.30

3260-0393 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 3260-0393 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3260-0393?
Check Price and Availability of 3260-0393, 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 3260-0393 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3260-0393
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3260-0393
  • 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 3260-0393 available by request