P518-0318 Screening compound: 5-cyclopropyl-N~2~-(2,3-dihydro-1H-inden-5-yl)-5,6-dihydro-4H-thieno[2,3-c]pyrrole-2-carboxamide

P518-0318 Screening compound: 5-cyclopropyl-N~2~-(2,3-dihydro-1H-inden-5-yl)-5,6-dihydro-4H-thieno[2,3-c]pyrrole-2-carboxamide
P518-0318 Screening compound: 5-cyclopropyl-N~2~-(2,3-dihydro-1H-inden-5-yl)-5,6-dihydro-4H-thieno[2,3-c]pyrrole-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P518-0318
5-cyclopropyl-N~2~-(2,3-dihydro-1H-inden-5-yl)-5,6-dihydro-4H-thieno[2,3-c]pyrrole-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

P518-0318

Molecular Formula

C19H20N2OS (C19 H20 N2 OS)

Compound Name

5-cyclopropyl-N~2~-(2,3-dihydro-1H-inden-5-yl)-5,6-dihydro-4H-thieno[2,3-c]pyrrole-2-carboxamide

IUPAC name

n/a

SMILES

O=C(c1cc(CN(C2)C3CC3)c2s1)Nc1cc(CCC2)c2cc1

InChI

InChI=1S/C19H20N2OS/c22-19(20-15-5-4-12-2-1-3-13(12)8-15)17-9-14-10-21(16-6-7-16)11-18(14)23-17/h4-5,8-9,16H,1-3,6-7,10-11H2,(H,20,22)

InChI Key

UMXUEDPPUWNFHR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27603701

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

324.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.359

Distribution Coefficient, logD

1.833

Water Solubility, LogSw

-4.33

Polar Surface Area

28.212

Acid Dissociation Constant (pKa)

12.10

Base Dissociation Constant (pKb)

9.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

P518-0318 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P518-0318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P518-0318?
Check Price and Availability of P518-0318, 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 P518-0318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P518-0318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P518-0318
  • 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 P518-0318 available by request