L497-2054 Screening compound: 5-chloro-N-[2-methyl-5-(thiomorpholine-4-sulfonyl)thiophen-3-yl]-1H-indole-2-carboxamide

L497-2054 Screening compound: 5-chloro-N-[2-methyl-5-(thiomorpholine-4-sulfonyl)thiophen-3-yl]-1H-indole-2-carboxamide
L497-2054 Screening compound: 5-chloro-N-[2-methyl-5-(thiomorpholine-4-sulfonyl)thiophen-3-yl]-1H-indole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L497-2054
5-chloro-N-[2-methyl-5-(thiomorpholine-4-sulfonyl)thiophen-3-yl]-1H-indole-2-carboxamide

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

L497-2054

Molecular Formula

C18H18ClN3O3S3 (C18 H18 ClN3 O3 S3)

Compound Name

5-chloro-N-[2-methyl-5-(thiomorpholine-4-sulfonyl)thiophen-3-yl]-1H-indole-2-carboxamide

IUPAC name

5-chloro-N-[2-methyl-5-(thiomorpholine-4-sulfonyl)thiophen-3-yl]-1H-indole-2-carboxamide

SMILES

Cc(sc(S(N1CCSCC1)(=O)=O)c1)c1NC(c1cc(cc(cc2)Cl)c2[nH]1)=O

InChI

InChI=1S/C18H18ClN3O3S3/c1-11-15(10-17(27-11)28(24,25)22-4-6-26-7-5-22)21-18(23)16-9-12-8-13(19)2-3-14(12)20-16/h2-3,8-10,20H,4-7H2,1H3,(H,21,23)

InChI Key

WVERFTJVGFYCHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27458092

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.01

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.322

Distribution Coefficient, logD

4.320

Water Solubility, LogSw

-4.53

Polar Surface Area

64.710

Acid Dissociation Constant (pKa)

9.87

Base Dissociation Constant (pKb)

-3.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

L497-2054 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Indole Derivatives (10091 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L497-2054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L497-2054?
Check Price and Availability of L497-2054, 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 L497-2054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L497-2054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L497-2054
  • 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 L497-2054 available by request