G837-0014 Screening compound: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

G837-0014 Screening compound: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide
G837-0014 Screening compound: N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G837-0014
N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

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

G837-0014

Molecular Formula

C18H16N4O5S2 (C18 H16 N4 O5 S2)

Compound Name

N-(6-nitro-1,3-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

IUPAC name

N-(6-nitro-13-benzothiazol-2-yl)-4-(pyrrolidine-1-sulfonyl)benzamide

SMILES

[O-][N+](c(cc1)cc2c1nc(NC(c(cc1)ccc1S(N1CCCC1)(=O)=O)=O)s2)=O

InChI

InChI=1S/C18H16N4O5S2/c23-17(20-18-19-15-8-5-13(22(24)25)11-16(15)28-18)12-3-6-14(7-4-12)29(26,27)21-9-1-2-10-21/h3-8,11H,1-2,9-10H2,(H,19,20,23)

InChI Key

AWGZARMCOZVZOI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01534285

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

432.48

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.550

Distribution Coefficient, logD

3.542

Water Solubility, LogSw

-3.94

Polar Surface Area

98.549

Acid Dissociation Constant (pKa)

9.14

Base Dissociation Constant (pKb)

-2.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.20

G837-0014 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with G837-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G837-0014?
Check Price and Availability of G837-0014, 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 G837-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G837-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G837-0014
  • 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 G837-0014 available by request