L586-1035 Screening compound: 5-(azepane-1-sulfonyl)-2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]benzamide

L586-1035 Screening compound: 5-(azepane-1-sulfonyl)-2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]benzamide
L586-1035 Screening compound: 5-(azepane-1-sulfonyl)-2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L586-1035
5-(azepane-1-sulfonyl)-2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]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

L586-1035

Molecular Formula

C22H31ClN4O3S (C22 H31 ClN4 O3 S)

Compound Name

5-(azepane-1-sulfonyl)-2-chloro-N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]benzamide

IUPAC name

5-(azepane-1-sulfonyl)-2-chloro-N-[2-(1-ethyl-35-dimethyl-1H-pyrazol-4-yl)ethyl]benzamide

SMILES

CCn1nc(C)c(CCNC(c(cc(cc2)S(N3CCCCCC3)(=O)=O)c2Cl)=O)c1C

InChI

InChI=1S/C22H31ClN4O3S/c1-4-27-17(3)19(16(2)25-27)11-12-24-22(28)20-15-18(9-10-21(20)23)31(29,30)26-13-7-5-6-8-14-26/h9-10,15H,4-8,11-14H2,1-3H3,(H,24,28)

InChI Key

XSAREMNRFAZUFN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15131325

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.03

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.460

Distribution Coefficient, logD

3.459

Water Solubility, LogSw

-3.96

Polar Surface Area

70.813

Acid Dissociation Constant (pKa)

11.88

Base Dissociation Constant (pKb)

4.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

54.50

L586-1035 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Lipid Metabolism Library (9174 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Cardiovascular
  • Metabolic
  • Nervous system
  • Cardiovascular
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L586-1035 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L586-1035?
Check Price and Availability of L586-1035, 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 L586-1035 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L586-1035
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L586-1035
  • 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 L586-1035 available by request