C518-0019 Screening compound: 6-chloro-N-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine

C518-0019 Screening compound: 6-chloro-N-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine
C518-0019 Screening compound: 6-chloro-N-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound C518-0019
6-chloro-N-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine

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

C518-0019

Molecular Formula

C21H21ClN2O2 (C21 H21 ClN2 O2)

Compound Name

6-chloro-N-(3,4-dimethoxyphenyl)-1,2,3,4-tetrahydroacridin-9-amine

IUPAC name

6-chloro-N-(34-dimethoxyphenyl)-1234-tetrahydroacridin-9-amine

SMILES

COc(ccc(Nc1c(ccc(Cl)c2)c2nc2c1CCCC2)c1)c1OC

InChI

InChI=1S/C21H21ClN2O2/c1-25-19-10-8-14(12-20(19)26-2)23-21-15-5-3-4-6-17(15)24-18-11-13(22)7-9-16(18)21/h7-12H,3-6H2,1-2H3,(H,23,24)

InChI Key

WPVUYOUEZBWHNY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14764200

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.86

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.315

Distribution Coefficient, logD

3.040

Water Solubility, LogSw

-5.90

Polar Surface Area

32.768

Acid Dissociation Constant (pKa)

16.37

Base Dissociation Constant (pKb)

9.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

C518-0019 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Angiogenesis library (14822 compounds)

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with C518-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C518-0019?
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What is the minimum amount of C518-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C518-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C518-0019
  • 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 C518-0019 available by request