G511-0042 Screening compound: N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-7-yl)-2,6-dimethoxybenzamide

G511-0042 Screening compound: N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-7-yl)-2,6-dimethoxybenzamide
G511-0042 Screening compound: N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-7-yl)-2,6-dimethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G511-0042
N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-7-yl)-2,6-dimethoxybenzamide

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

G511-0042

Molecular Formula

C22H24N2O4 (C22 H24 N2 O4)

Compound Name

N-(1-cyclopropanecarbonyl-1,2,3,4-tetrahydroquinolin-7-yl)-2,6-dimethoxybenzamide

IUPAC name

N-(1-cyclopropanecarbonyl-1234-tetrahydroquinolin-7-yl)-26-dimethoxybenzamide

SMILES

COc1cccc(OC)c1C(Nc1cc(N(CCC2)C(C3CC3)=O)c2cc1)=O

InChI

InChI=1S/C22H24N2O4/c1-27-18-6-3-7-19(28-2)20(18)21(25)23-16-11-10-14-5-4-12-24(17(14)13-16)22(26)15-8-9-15/h3,6-7,10-11,13,15H,4-5,8-9,12H2,1-2H3,(H,23,25)

InChI Key

UQVDTWLBBBKVGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08007780

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.079

Distribution Coefficient, logD

3.051

Water Solubility, LogSw

-3.51

Polar Surface Area

54.426

Acid Dissociation Constant (pKa)

8.57

Base Dissociation Constant (pKb)

1.86

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

G511-0042 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G511-0042 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G511-0042?
Check Price and Availability of G511-0042, 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 G511-0042 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G511-0042
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G511-0042
  • 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 G511-0042 available by request