6768-0657 Screening compound: N-benzyl-N,1,3-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide

6768-0657 Screening compound: N-benzyl-N,1,3-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide
6768-0657 Screening compound: N-benzyl-N,1,3-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6768-0657
N-benzyl-N,1,3-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-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

6768-0657

Molecular Formula

C17H19N3O3S (C17 H19 N3 O3 S)

Compound Name

N-benzyl-N,1,3-trimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide

IUPAC name

N-benzyl-N13-trimethyl-2-oxo-23-dihydro-1H-13-benzodiazole-5-sulfonamide

SMILES

CN(Cc1ccccc1)S(c(cc1)cc(N2C)c1N(C)C2=O)(=O)=O

InChI

InChI=1S/C17H19N3O3S/c1-18(12-13-7-5-4-6-8-13)24(22,23)14-9-10-15-16(11-14)20(3)17(21)19(15)2/h4-11H,12H2,1-3H3

InChI Key

SYWXWCITJAGWAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04444092

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.656

Distribution Coefficient, logD

2.656

Water Solubility, LogSw

-3.19

Polar Surface Area

50.487

Acid Dissociation Constant (pKa)

27.18

Base Dissociation Constant (pKb)

-3.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

6768-0657 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 6768-0657 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6768-0657?
Check Price and Availability of 6768-0657, 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 6768-0657 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6768-0657
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6768-0657
  • 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 6768-0657 available by request