L581-0307 Screening compound: N~3~-butyl-1-(3-{[(3-methoxyphenyl)sulfonyl]amino}benzoyl)-3-piperidinecarboxamide

L581-0307 Screening compound: N~3~-butyl-1-(3-{[(3-methoxyphenyl)sulfonyl]amino}benzoyl)-3-piperidinecarboxamide
L581-0307 Screening compound: N~3~-butyl-1-(3-{[(3-methoxyphenyl)sulfonyl]amino}benzoyl)-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L581-0307
N~3~-butyl-1-(3-{[(3-methoxyphenyl)sulfonyl]amino}benzoyl)-3-piperidinecarboxamide

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

L581-0307

Molecular Formula

C24H31N3O5S (C24 H31 N3 O5 S)

Compound Name

N~3~-butyl-1-(3-{[(3-methoxyphenyl)sulfonyl]amino}benzoyl)-3-piperidinecarboxamide

IUPAC name

n/a

SMILES

CCCCNC(C(CCC1)CN1C(c1cccc(NS(c2cc(OC)ccc2)(=O)=O)c1)=O)=O

InChI

InChI=1S/C24H31N3O5S/c1-3-4-13-25-23(28)19-9-7-14-27(17-19)24(29)18-8-5-10-20(15-18)26-33(30,31)22-12-6-11-21(16-22)32-2/h5-6,8,10-12,15-16,19,26H,3-4,7,9,13-14,17H2,1-2H3,(H,25,28)/t19-/m0/s1

InChI Key

ZKXVIRYOZQEGAU-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27463767

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.59

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.092

Distribution Coefficient, logD

3.090

Water Solubility, LogSw

-3.51

Polar Surface Area

89.540

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

4.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

41.70

L581-0307 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Immune system
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • Receptor's ligands

References: we are preparing a list of scientific research reports with L581-0307 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L581-0307?
Check Price and Availability of L581-0307, 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 L581-0307 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L581-0307
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L581-0307
  • 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 L581-0307 available by request