C498-1182 Screening compound: 3-chloro-N-(1,2,3,4-tetrahydroacridin-9-yl)benzamide

C498-1182 Screening compound: 3-chloro-N-(1,2,3,4-tetrahydroacridin-9-yl)benzamide
C498-1182 Screening compound: 3-chloro-N-(1,2,3,4-tetrahydroacridin-9-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C498-1182
3-chloro-N-(1,2,3,4-tetrahydroacridin-9-yl)benzamide

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

C498-1182

Molecular Formula

C20H17ClN2O (C20 H17 ClN2 O)

Compound Name

3-chloro-N-(1,2,3,4-tetrahydroacridin-9-yl)benzamide

IUPAC name

3-chloro-N-(1234-tetrahydroacridin-9-yl)benzamide

SMILES

O=C(c1cccc(Cl)c1)Nc1c(CCCC2)c2nc2ccccc12

InChI

InChI=1S/C20H17ClN2O/c21-14-7-5-6-13(12-14)20(24)23-19-15-8-1-3-10-17(15)22-18-11-4-2-9-16(18)19/h1,3,5-8,10,12H,2,4,9,11H2,(H,22,23,24)

InChI Key

PAXRSKPJHYLAOA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14762337

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.82

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.637

Distribution Coefficient, logD

4.510

Water Solubility, LogSw

-4.90

Polar Surface Area

31.686

Acid Dissociation Constant (pKa)

8.32

Base Dissociation Constant (pKb)

6.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

C498-1182 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C498-1182 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C498-1182?
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What is the minimum amount of C498-1182 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C498-1182
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C498-1182
  • 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 C498-1182 available by request