5594-2605 Screening compound: 2,2,4-trimethyl-N-(4-methylphenyl)-1,2-dihydroquinoline-1-carboxamide

5594-2605 Screening compound: 2,2,4-trimethyl-N-(4-methylphenyl)-1,2-dihydroquinoline-1-carboxamide
5594-2605 Screening compound: 2,2,4-trimethyl-N-(4-methylphenyl)-1,2-dihydroquinoline-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 5594-2605
2,2,4-trimethyl-N-(4-methylphenyl)-1,2-dihydroquinoline-1-carboxamide

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

5594-2605

Molecular Formula

C20H22N2O (C20 H22 N2 O)

Compound Name

2,2,4-trimethyl-N-(4-methylphenyl)-1,2-dihydroquinoline-1-carboxamide

IUPAC name

224-trimethyl-N-(4-methylphenyl)-12-dihydroquinoline-1-carboxamide

SMILES

CC1(C)N(C(Nc2ccc(C)cc2)=O)c(cccc2)c2C(C)=C1

InChI

InChI=1S/C20H22N2O/c1-14-9-11-16(12-10-14)21-19(23)22-18-8-6-5-7-17(18)15(2)13-20(22,3)4/h5-13H,1-4H3,(H,21,23)

InChI Key

STWNXIFFMVAOAP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02817216

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

306.41

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.089

Distribution Coefficient, logD

5.089

Water Solubility, LogSw

-4.92

Polar Surface Area

23.145

Acid Dissociation Constant (pKa)

14.88

Base Dissociation Constant (pKb)

0.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 5594-2605 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5594-2605?
Check Price and Availability of 5594-2605, 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 5594-2605 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5594-2605
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5594-2605
  • 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 5594-2605 available by request