D305-1756 Screening compound: N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-4-fluorobenzamide

D305-1756 Screening compound: N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-4-fluorobenzamide
D305-1756 Screening compound: N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-4-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D305-1756
N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-4-fluorobenzamide

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

D305-1756

Molecular Formula

C21H23FN4O (C21 H23 FN4 O)

Compound Name

N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-1,3-benzodiazol-5-yl}-4-fluorobenzamide

IUPAC name

N-{1-ethyl-2-[(pyrrolidin-1-yl)methyl]-1H-13-benzodiazol-5-yl}-4-fluorobenzamide

SMILES

CCn1c(ccc(NC(c(cc2)ccc2F)=O)c2)c2nc1CN1CCCC1

InChI

InChI=1S/C21H23FN4O/c1-2-26-19-10-9-17(23-21(27)15-5-7-16(22)8-6-15)13-18(19)24-20(26)14-25-11-3-4-12-25/h5-10,13H,2-4,11-12,14H2,1H3,(H,23,27)

InChI Key

JNAQBZHRDATZRS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14817892

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.44

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.593

Distribution Coefficient, logD

3.194

Water Solubility, LogSw

-3.70

Polar Surface Area

38.329

Acid Dissociation Constant (pKa)

10.04

Base Dissociation Constant (pKb)

7.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D305-1756 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with D305-1756 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D305-1756?
Check Price and Availability of D305-1756, 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 D305-1756 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D305-1756
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D305-1756
  • 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 D305-1756 available by request