E570-1944 Screening compound: ethyl 4-{1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]pyrrolidine-2-carbonyl}piperazine-1-carboxylate

E570-1944 Screening compound: ethyl 4-{1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]pyrrolidine-2-carbonyl}piperazine-1-carboxylate
E570-1944 Screening compound: ethyl 4-{1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]pyrrolidine-2-carbonyl}piperazine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound E570-1944
ethyl 4-{1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]pyrrolidine-2-carbonyl}piperazine-1-carboxylate

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

E570-1944

Molecular Formula

C23H32N4O6S (C23 H32 N4 O6 S)

Compound Name

ethyl 4-{1-[(1-acetyl-2-methyl-2,3-dihydro-1H-indol-5-yl)sulfonyl]pyrrolidine-2-carbonyl}piperazine-1-carboxylate

IUPAC name

ethyl 4-{1-[(1-acetyl-2-methyl-23-dihydro-1H-indol-5-yl)sulfonyl]pyrrolidine-2-carbonyl}piperazine-1-carboxylate

SMILES

CCOC(N(CC1)CCN1C(C(CCC1)N1S(c(cc1)cc(CC2C)c1N2C(C)=O)(=O)=O)=O)=O

InChI

InChI=1S/C23H32N4O6S/c1-4-33-23(30)25-12-10-24(11-13-25)22(29)21-6-5-9-26(21)34(31,32)19-7-8-20-18(15-19)14-16(2)27(20)17(3)28/h7-8,15-16,21H,4-6,9-14H2,1-3H3

InChI Key

GZRYDZXAIZERBW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14899752

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

492.6

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.278

Distribution Coefficient, logD

1.278

Water Solubility, LogSw

-2.56

Polar Surface Area

87.572

Acid Dissociation Constant (pKa)

20.25

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

60.90

E570-1944 in Drug Discovery

Included in Screening Libraries

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

References: we are preparing a list of scientific research reports with E570-1944 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E570-1944?
Check Price and Availability of E570-1944, 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 E570-1944 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E570-1944
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E570-1944
  • 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 E570-1944 available by request