D516-0152 Screening compound: N-[2-(5-acetamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-3-fluorobenzamide

D516-0152 Screening compound: N-[2-(5-acetamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-3-fluorobenzamide
D516-0152 Screening compound: N-[2-(5-acetamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D516-0152
N-[2-(5-acetamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-3-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

D516-0152

Molecular Formula

C19H19FN4O2 (C19 H19 FN4 O2)

Compound Name

N-[2-(5-acetamido-1-methyl-1H-1,3-benzodiazol-2-yl)ethyl]-3-fluorobenzamide

IUPAC name

N-[2-(5-acetamido-1-methyl-1H-13-benzodiazol-2-yl)ethyl]-3-fluorobenzamide

SMILES

CC(Nc(cc1)cc2c1n(C)c(CCNC(c1cccc(F)c1)=O)n2)=O

InChI

InChI=1S/C19H19FN4O2/c1-12(25)22-15-6-7-17-16(11-15)23-18(24(17)2)8-9-21-19(26)13-4-3-5-14(20)10-13/h3-7,10-11H,8-9H2,1-2H3,(H,21,26)(H,22,25)

InChI Key

OCOBZNVDSLYBLR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14833016

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.38

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.912

Distribution Coefficient, logD

1.907

Water Solubility, LogSw

-2.60

Polar Surface Area

59.742

Acid Dissociation Constant (pKa)

12.31

Base Dissociation Constant (pKb)

5.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

D516-0152 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D516-0152 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D516-0152?
Check Price and Availability of D516-0152, 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 D516-0152 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D516-0152
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D516-0152
  • 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 D516-0152 available by request