D305-2509 Screening compound: N-{1-ethyl-2-[(1H-pyrazol-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-methoxybenzamide

D305-2509 Screening compound: N-{1-ethyl-2-[(1H-pyrazol-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-methoxybenzamide
D305-2509 Screening compound: N-{1-ethyl-2-[(1H-pyrazol-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-2509
N-{1-ethyl-2-[(1H-pyrazol-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-methoxybenzamide

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

D305-2509

Molecular Formula

C21H21N5O2 (C21 H21 N5 O2)

Compound Name

N-{1-ethyl-2-[(1H-pyrazol-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-2-methoxybenzamide

IUPAC name

N-{1-ethyl-2-[(1H-pyrazol-1-yl)methyl]-1H-13-benzodiazol-5-yl}-2-methoxybenzamide

SMILES

CCn1c(ccc(NC(c(cccc2)c2OC)=O)c2)c2nc1Cn1nccc1

InChI

InChI=1S/C21H21N5O2/c1-3-26-18-10-9-15(23-21(27)16-7-4-5-8-19(16)28-2)13-17(18)24-20(26)14-25-12-6-11-22-25/h4-13H,3,14H2,1-2H3,(H,23,27)

InChI Key

JESCSCCPFDEOMH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09164148

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.889

Distribution Coefficient, logD

2.886

Water Solubility, LogSw

-3.53

Polar Surface Area

56.384

Acid Dissociation Constant (pKa)

9.70

Base Dissociation Constant (pKb)

4.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

D305-2509 in Drug Discovery

Included in Screening Libraries

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

Targeted Diversity Library (40567 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with D305-2509 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-2509?
Check Price and Availability of D305-2509, 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 D305-2509 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-2509
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-2509
  • 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 D305-2509 available by request