L639-0260 Screening compound: N-[(3-bromophenyl)methyl]-1-{6H-thieno[2,3-b]pyrrole-5-carbonyl}piperidine-4-carboxamide

L639-0260 Screening compound: N-[(3-bromophenyl)methyl]-1-{6H-thieno[2,3-b]pyrrole-5-carbonyl}piperidine-4-carboxamide
L639-0260 Screening compound: N-[(3-bromophenyl)methyl]-1-{6H-thieno[2,3-b]pyrrole-5-carbonyl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L639-0260
N-[(3-bromophenyl)methyl]-1-{6H-thieno[2,3-b]pyrrole-5-carbonyl}piperidine-4-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

L639-0260

Molecular Formula

C20H20BrN3O2S (C20 H20 BrN3 O2 S)

Compound Name

N-[(3-bromophenyl)methyl]-1-{6H-thieno[2,3-b]pyrrole-5-carbonyl}piperidine-4-carboxamide

IUPAC name

N-[(3-bromophenyl)methyl]-1-{6H-thieno[23-b]pyrrole-5-carbonyl}piperidine-4-carboxamide

SMILES

O=C(C(CC1)CCN1C(c([nH]1)cc2c1scc2)=O)NCc1cccc(Br)c1

InChI

InChI=1S/C20H20BrN3O2S/c21-16-3-1-2-13(10-16)12-22-18(25)14-4-7-24(8-5-14)20(26)17-11-15-6-9-27-19(15)23-17/h1-3,6,9-11,14,23H,4-5,7-8,12H2,(H,22,25)

InChI Key

DJYZAFDINVSNLO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15132561

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.37

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.441

Distribution Coefficient, logD

3.441

Water Solubility, LogSw

-3.69

Polar Surface Area

52.039

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

L639-0260 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 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
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L639-0260 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L639-0260?
Check Price and Availability of L639-0260, 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 L639-0260 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L639-0260
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L639-0260
  • 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 L639-0260 available by request