8019-0359 Screening compound: 3-(4-chlorobenzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-amine

8019-0359 Screening compound: 3-(4-chlorobenzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-amine
8019-0359 Screening compound: 3-(4-chlorobenzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-0359
3-(4-chlorobenzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-amine

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

8019-0359

Molecular Formula

C15H19ClN2O2S (C15 H19 ClN2 O2 S)

Compound Name

3-(4-chlorobenzenesulfonyl)-4,5-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-amine

IUPAC name

3-(4-chlorobenzenesulfonyl)-45-dimethyl-1-(propan-2-yl)-1H-pyrrol-2-amine

SMILES

CC(C)n(c(C)c1C)c(N)c1S(c(cc1)ccc1Cl)(=O)=O

InChI

InChI=1S/C15H19ClN2O2S/c1-9(2)18-11(4)10(3)14(15(18)17)21(19,20)13-7-5-12(16)6-8-13/h5-9H,17H2,1-4H3

InChI Key

CZOJYFJDJDFZAC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09063859

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

326.85

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.152

Distribution Coefficient, logD

3.152

Water Solubility, LogSw

-3.41

Polar Surface Area

52.035

Acid Dissociation Constant (pKa)

19.67

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

8019-0359 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Adenosine Receptors Targeted Library (19896 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Agro:
  • Agro
  • Agro
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8019-0359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-0359?
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What is the minimum amount of 8019-0359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-0359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-0359
  • 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 8019-0359 available by request