7163-0213 Screening compound: methyl 4-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamido)benzoate

7163-0213 Screening compound: methyl 4-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamido)benzoate
7163-0213 Screening compound: methyl 4-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7163-0213
methyl 4-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamido)benzoate

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

7163-0213

Molecular Formula

C17H17N3O5S (C17 H17 N3 O5 S)

Compound Name

methyl 4-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamido)benzoate

IUPAC name

methyl 4-(13-dimethyl-2-oxo-23-dihydro-1H-13-benzodiazole-5-sulfonamido)benzoate

SMILES

CN(c(ccc(S(Nc(cc1)ccc1C(OC)=O)(=O)=O)c1)c1N1C)C1=O

InChI

InChI=1S/C17H17N3O5S/c1-19-14-9-8-13(10-15(14)20(2)17(19)22)26(23,24)18-12-6-4-11(5-7-12)16(21)25-3/h4-10,18H,1-3H3

InChI Key

IBKXWNBAJLDICD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05668363

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.569

Distribution Coefficient, logD

2.428

Water Solubility, LogSw

-3.11

Polar Surface Area

79.747

Acid Dissociation Constant (pKa)

7.82

Base Dissociation Constant (pKb)

-3.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

7163-0213 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-Aging Library (44940 compounds)

SH2 Library (10483 compounds)

Serine Proteases Inhibitors Library (32732 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
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
  • Proteases
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with 7163-0213 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7163-0213?
Check Price and Availability of 7163-0213, 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 7163-0213 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7163-0213
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7163-0213
  • 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 7163-0213 available by request