E570-2008 Screening compound: 1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]-2-pyrrolidinecarboxamide

E570-2008 Screening compound: 1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]-2-pyrrolidinecarboxamide
E570-2008 Screening compound: 1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]-2-pyrrolidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E570-2008
1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]-2-pyrrolidinecarboxamide

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

E570-2008

Molecular Formula

C23H27N3O4S2 (C23 H27 N3 O4 S2)

Compound Name

1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]-2-pyrrolidinecarboxamide

IUPAC name

1-[(1-acetyl-2-methyl-23-dihydro-1H-indol-5-yl)sulfonyl]-N-[3-(methylsulfanyl)phenyl]pyrrolidine-2-carboxamide

SMILES

CC(C1)N(C(C)=O)c(cc2)c1cc2S(N(CCC1)C1C(Nc1cc(SC)ccc1)=O)(=O)=O

InChI

InChI=1S/C23H27N3O4S2/c1-15-12-17-13-20(9-10-21(17)26(15)16(2)27)32(29,30)25-11-5-8-22(25)23(28)24-18-6-4-7-19(14-18)31-3/h4,6-7,9-10,13-15,22H,5,8,11-12H2,1-3H3,(H,24,28)

InChI Key

DFEODRJVQUNQCB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899764

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.863

Distribution Coefficient, logD

2.863

Water Solubility, LogSw

-3.53

Polar Surface Area

71.235

Acid Dissociation Constant (pKa)

11.19

Base Dissociation Constant (pKb)

-1.30

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.13

E570-2008 in Drug Discovery

Included in Screening Libraries

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with E570-2008 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E570-2008?
Check Price and Availability of E570-2008, 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 E570-2008 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E570-2008
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E570-2008
  • 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 E570-2008 available by request