2137-1092 Screening compound: N-tert-butyl-2-chlorobenzamide

2137-1092 Screening compound: N-tert-butyl-2-chlorobenzamide
2137-1092 Screening compound: N-tert-butyl-2-chlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2137-1092
N-tert-butyl-2-chlorobenzamide

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

2137-1092

Molecular Formula

C11H14ClNO (C11 H14 ClNO)

Compound Name

N-tert-butyl-2-chlorobenzamide

IUPAC name

N-tert-butyl-2-chlorobenzamide

SMILES

CC(C)(C)NC(c(cccc1)c1Cl)=O

InChI

InChI=1S/C11H14ClNO/c1-11(2,3)13-10(14)8-6-4-5-7-9(8)12/h4-7H,1-3H3,(H,13,14)

InChI Key

BYWGSUJLXJLBLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00751501

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

211.69

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.915

Distribution Coefficient, logD

2.915

Water Solubility, LogSw

-3.70

Polar Surface Area

23.747

Acid Dissociation Constant (pKa)

12.82

Base Dissociation Constant (pKb)

0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

2137-1092 in Drug Discovery

Included in Screening Libraries

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 2137-1092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2137-1092?
Check Price and Availability of 2137-1092, 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 2137-1092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2137-1092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2137-1092
  • 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 2137-1092 available by request