F379-0130 Screening compound: 1'-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,4'-bipiperidine

F379-0130 Screening compound: 1'-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,4'-bipiperidine
F379-0130 Screening compound: 1'-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,4'-bipiperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound F379-0130
1'-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,4'-bipiperidine

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

F379-0130

Molecular Formula

C21H34N4O3S (C21 H34 N4 O3 S)

Compound Name

1'-[3,5-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,4'-bipiperidine

IUPAC name

1'-[35-dimethyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-14'-bipiperidine

SMILES

Cc1c(C(N(CC2)CCC2N2CCCCC2)=O)[nH]c(C)c1S(N1CCCC1)(=O)=O

InChI

InChI=1S/C21H34N4O3S/c1-16-19(22-17(2)20(16)29(27,28)25-12-6-7-13-25)21(26)24-14-8-18(9-15-24)23-10-4-3-5-11-23/h18,22H,3-15H2,1-2H3

InChI Key

OVAMQADYIOPTTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27121184

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.59

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.954

Distribution Coefficient, logD

-1.485

Water Solubility, LogSw

-2.42

Polar Surface Area

63.039

Acid Dissociation Constant (pKa)

6.39

Base Dissociation Constant (pKb)

10.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

76.20

F379-0130 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with F379-0130 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F379-0130?
Check Price and Availability of F379-0130, 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 F379-0130 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F379-0130
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F379-0130
  • 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 F379-0130 available by request