D348-0159 Screening compound: 1-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide

D348-0159 Screening compound: 1-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide
D348-0159 Screening compound: 1-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D348-0159
1-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroquinoline-6-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

D348-0159

Molecular Formula

C20H24N2O3S (C20 H24 N2 O3 S)

Compound Name

1-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-1,2,3,4-tetrahydroquinoline-6-carboxamide

IUPAC name

1-(ethanesulfonyl)-N-[(4-methylphenyl)methyl]-1234-tetrahydroquinoline-6-carboxamide

SMILES

CCS(N(CCC1)c(cc2)c1cc2C(NCc1ccc(C)cc1)=O)(=O)=O

InChI

InChI=1S/C20H24N2O3S/c1-3-26(24,25)22-12-4-5-17-13-18(10-11-19(17)22)20(23)21-14-16-8-6-15(2)7-9-16/h6-11,13H,3-5,12,14H2,1-2H3,(H,21,23)

InChI Key

GBROBJYPOZFXDS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09671654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.696

Distribution Coefficient, logD

2.696

Water Solubility, LogSw

-3.18

Polar Surface Area

55.970

Acid Dissociation Constant (pKa)

10.96

Base Dissociation Constant (pKb)

-2.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

D348-0159 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with D348-0159 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D348-0159?
Check Price and Availability of D348-0159, 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 D348-0159 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D348-0159
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D348-0159
  • 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 D348-0159 available by request