4567-0793 Screening compound: 2-[N-(2,3-dimethylphenyl)methanesulfonamido]-N-[(pyridin-2-yl)methyl]acetamide

4567-0793 Screening compound: 2-[N-(2,3-dimethylphenyl)methanesulfonamido]-N-[(pyridin-2-yl)methyl]acetamide
4567-0793 Screening compound: 2-[N-(2,3-dimethylphenyl)methanesulfonamido]-N-[(pyridin-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4567-0793
2-[N-(2,3-dimethylphenyl)methanesulfonamido]-N-[(pyridin-2-yl)methyl]acetamide

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

4567-0793

Molecular Formula

C17H21N3O3S (C17 H21 N3 O3 S)

Compound Name

2-[N-(2,3-dimethylphenyl)methanesulfonamido]-N-[(pyridin-2-yl)methyl]acetamide

IUPAC name

2-[N-(23-dimethylphenyl)methanesulfonamido]-N-[(pyridin-2-yl)methyl]acetamide

SMILES

Cc1cccc(N(CC(NCc2ncccc2)=O)S(C)(=O)=O)c1C

InChI

InChI=1S/C17H21N3O3S/c1-13-7-6-9-16(14(13)2)20(24(3,22)23)12-17(21)19-11-15-8-4-5-10-18-15/h4-10H,11-12H2,1-3H3,(H,19,21)

InChI Key

YDBDGPXRYGCDHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03119464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.979

Distribution Coefficient, logD

1.978

Water Solubility, LogSw

-2.39

Polar Surface Area

65.270

Acid Dissociation Constant (pKa)

13.02

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

4567-0793 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 4567-0793 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4567-0793?
Check Price and Availability of 4567-0793, 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 4567-0793 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4567-0793
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4567-0793
  • 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 4567-0793 available by request