P518-0140 Screening compound: (5-isopropyl-5,6-dihydro-4H-thieno[2,3-c]pyrrol-2-yl)(1-pyrrolidinyl)methanone

P518-0140 Screening compound: (5-isopropyl-5,6-dihydro-4H-thieno[2,3-c]pyrrol-2-yl)(1-pyrrolidinyl)methanone
P518-0140 Screening compound: (5-isopropyl-5,6-dihydro-4H-thieno[2,3-c]pyrrol-2-yl)(1-pyrrolidinyl)methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound P518-0140
(5-isopropyl-5,6-dihydro-4H-thieno[2,3-c]pyrrol-2-yl)(1-pyrrolidinyl)methanone

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

P518-0140

Molecular Formula

C14H20N2OS (C14 H20 N2 OS)

Compound Name

(5-isopropyl-5,6-dihydro-4H-thieno[2,3-c]pyrrol-2-yl)(1-pyrrolidinyl)methanone

IUPAC name

1-[5-(propan-2-yl)-4H5H6H-thieno[23-c]pyrrole-2-carbonyl]pyrrolidine

SMILES

CC(C)N(C1)Cc2c1cc(C(N1CCCC1)=O)s2

InChI

InChI=1S/C14H20N2OS/c1-10(2)16-8-11-7-12(18-13(11)9-16)14(17)15-5-3-4-6-15/h7,10H,3-6,8-9H2,1-2H3

InChI Key

XVMOCKGPRBFDTI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27603639

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.638

Distribution Coefficient, logD

-1.515

Water Solubility, LogSw

-2.85

Polar Surface Area

22.288

Acid Dissociation Constant (pKa)

25.50

Base Dissociation Constant (pKb)

11.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

64.29

P518-0140 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with P518-0140 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P518-0140?
Check Price and Availability of P518-0140, 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 P518-0140 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P518-0140
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P518-0140
  • 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 P518-0140 available by request