8018-1033 Screening compound: N-benzyl-4,8-dimethyl-2-oxo-1,2-dihydroquinoline-6-sulfonamide

8018-1033 Screening compound: N-benzyl-4,8-dimethyl-2-oxo-1,2-dihydroquinoline-6-sulfonamide
8018-1033 Screening compound: N-benzyl-4,8-dimethyl-2-oxo-1,2-dihydroquinoline-6-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-1033
N-benzyl-4,8-dimethyl-2-oxo-1,2-dihydroquinoline-6-sulfonamide

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

8018-1033

Molecular Formula

C18H18N2O3S (C18 H18 N2 O3 S)

Compound Name

N-benzyl-4,8-dimethyl-2-oxo-1,2-dihydroquinoline-6-sulfonamide

IUPAC name

N-benzyl-48-dimethyl-2-oxo-12-dihydroquinoline-6-sulfonamide

SMILES

Cc1cc(S(NCc2ccccc2)(=O)=O)cc(C(C)=C2)c1NC2=O

InChI

InChI=1S/C18H18N2O3S/c1-12-9-17(21)20-18-13(2)8-15(10-16(12)18)24(22,23)19-11-14-6-4-3-5-7-14/h3-10,19H,11H2,1-2H3,(H,20,21)

InChI Key

OTHPCDDWWLQOQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07022597

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.701

Distribution Coefficient, logD

2.665

Water Solubility, LogSw

-3.37

Polar Surface Area

64.565

Acid Dissociation Constant (pKa)

8.46

Base Dissociation Constant (pKb)

-4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8018-1033 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool

References: we are preparing a list of scientific research reports with 8018-1033 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-1033?
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What is the minimum amount of 8018-1033 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-1033
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-1033
  • 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 8018-1033 available by request