3931-2002 Screening compound: N-(3,4-dimethylphenyl)-7-methyl-1H,2H,3H-cyclopenta[b]quinolin-9-amine

3931-2002 Screening compound: N-(3,4-dimethylphenyl)-7-methyl-1H,2H,3H-cyclopenta[b]quinolin-9-amine
3931-2002 Screening compound: N-(3,4-dimethylphenyl)-7-methyl-1H,2H,3H-cyclopenta[b]quinolin-9-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3931-2002
N-(3,4-dimethylphenyl)-7-methyl-1H,2H,3H-cyclopenta[b]quinolin-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

3931-2002

Molecular Formula

C21H22N2 (C21 H22 N2)

Compound Name

N-(3,4-dimethylphenyl)-7-methyl-1H,2H,3H-cyclopenta[b]quinolin-9-amine

IUPAC name

N-(34-dimethylphenyl)-7-methyl-1H2H3H-cyclopenta[b]quinolin-9-amine

SMILES

Cc(cc12)ccc2nc(CCC2)c2c1Nc1cc(C)c(C)cc1

InChI

InChI=1S/C21H22N2/c1-13-7-10-20-18(11-13)21(17-5-4-6-19(17)23-20)22-16-9-8-14(2)15(3)12-16/h7-12H,4-6H2,1-3H3,(H,22,23)

InChI Key

LNKHGWFCSWRXFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03294620

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

302.42

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.920

Distribution Coefficient, logD

4.372

Water Solubility, LogSw

-5.57

Polar Surface Area

17.873

Acid Dissociation Constant (pKa)

16.97

Base Dissociation Constant (pKb)

8.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

3931-2002 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3931-2002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3931-2002?
Check Price and Availability of 3931-2002, 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 3931-2002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3931-2002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3931-2002
  • 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 3931-2002 available by request