L470-0682 Screening compound: N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-ethoxybenzamide

L470-0682 Screening compound: N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-ethoxybenzamide
L470-0682 Screening compound: N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-ethoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L470-0682
N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-ethoxybenzamide

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

L470-0682

Molecular Formula

C20H26N2O4S2 (C20 H26 N2 O4 S2)

Compound Name

N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-ethoxybenzamide

IUPAC name

N-{[5-(azepane-1-sulfonyl)thiophen-2-yl]methyl}-4-ethoxybenzamide

SMILES

CCOc(cc1)ccc1C(NCc(s1)ccc1S(N1CCCCCC1)(=O)=O)=O

InChI

InChI=1S/C20H26N2O4S2/c1-2-26-17-9-7-16(8-10-17)20(23)21-15-18-11-12-19(27-18)28(24,25)22-13-5-3-4-6-14-22/h7-12H,2-6,13-15H2,1H3,(H,21,23)

InChI Key

KTWCFFNNJIQHTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27255035

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.918

Distribution Coefficient, logD

3.918

Water Solubility, LogSw

-3.79

Polar Surface Area

64.836

Acid Dissociation Constant (pKa)

12.81

Base Dissociation Constant (pKb)

-3.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.00

L470-0682 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L470-0682 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L470-0682?
Check Price and Availability of L470-0682, 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 L470-0682 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L470-0682
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L470-0682
  • 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 L470-0682 available by request