E203-0093 Screening compound: 2-[1-methyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline

E203-0093 Screening compound: 2-[1-methyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline
E203-0093 Screening compound: 2-[1-methyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound E203-0093
2-[1-methyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline

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

E203-0093

Molecular Formula

C19H23N3O3S (C19 H23 N3 O3 S)

Compound Name

2-[1-methyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline

IUPAC name

2-[1-methyl-4-(pyrrolidine-1-sulfonyl)-1H-pyrrole-2-carbonyl]-1234-tetrahydroisoquinoline

SMILES

Cn1c(C(N(CC2)Cc3c2cccc3)=O)cc(S(N2CCCC2)(=O)=O)c1

InChI

InChI=1S/C19H23N3O3S/c1-20-14-17(26(24,25)22-9-4-5-10-22)12-18(20)19(23)21-11-8-15-6-2-3-7-16(15)13-21/h2-3,6-7,12,14H,4-5,8-11,13H2,1H3

InChI Key

YDZRGRDAULKCBK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10822654

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

373.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.106

Distribution Coefficient, logD

2.106

Water Solubility, LogSw

-2.73

Polar Surface Area

50.935

Acid Dissociation Constant (pKa)

26.00

Base Dissociation Constant (pKb)

-0.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.10

E203-0093 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • 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 E203-0093 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E203-0093?
Check Price and Availability of E203-0093, 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 E203-0093 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E203-0093
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E203-0093
  • 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 E203-0093 available by request