L893-0205 Screening compound: 3-(piperidin-1-ylcarbonyl)-5-(pyrrolidin-1-ylsulfonyl)-1,2-benzisoxazole

L893-0205 Screening compound: 3-(piperidin-1-ylcarbonyl)-5-(pyrrolidin-1-ylsulfonyl)-1,2-benzisoxazole
L893-0205 Screening compound: 3-(piperidin-1-ylcarbonyl)-5-(pyrrolidin-1-ylsulfonyl)-1,2-benzisoxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound L893-0205
3-(piperidin-1-ylcarbonyl)-5-(pyrrolidin-1-ylsulfonyl)-1,2-benzisoxazole

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

L893-0205

Molecular Formula

C24H25FN4O2 (C24 H25 FN4 O2)

Compound Name

3-(piperidin-1-ylcarbonyl)-5-(pyrrolidin-1-ylsulfonyl)-1,2-benzisoxazole

IUPAC name

N-[(2-fluorophenyl)methyl]-1-[3-(4-methylphenoxy)pyrazin-2-yl]piperidine-4-carboxamide

SMILES

Cc(cc1)ccc1Oc1nccnc1N(CC1)CCC1C(NCc(cccc1)c1F)=O

InChI

InChI=1S/C24H25FN4O2/c1-17-6-8-20(9-7-17)31-24-22(26-12-13-27-24)29-14-10-18(11-15-29)23(30)28-16-19-4-2-3-5-21(19)25/h2-9,12-13,18H,10-11,14-16H2,1H3,(H,28,30)

InChI Key

RRWJQXGAIVTGPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27484507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

420.49

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.614

Distribution Coefficient, logD

4.614

Water Solubility, LogSw

-4.25

Polar Surface Area

53.638

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

L893-0205 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L893-0205 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L893-0205?
Check Price and Availability of L893-0205, 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 L893-0205 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L893-0205
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L893-0205
  • 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 L893-0205 available by request