F602-0888 Screening compound: ethyl 5-(3-{[2-(1H-indol-3-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

F602-0888 Screening compound: ethyl 5-(3-{[2-(1H-indol-3-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
F602-0888 Screening compound: ethyl 5-(3-{[2-(1H-indol-3-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F602-0888
ethyl 5-(3-{[2-(1H-indol-3-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-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

F602-0888

Molecular Formula

C26H32N4O4 (C26 H32 N4 O4)

Compound Name

ethyl 5-(3-{[2-(1H-indol-3-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 5-(3-{[2-(1H-indol-3-yl)ethyl]carbamoyl}piperidine-1-carbonyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(C(N(CCC2)CC2C(NCCc2c[nH]c3c2cccc3)=O)=O)c1C)=O

InChI

InChI=1S/C26H32N4O4/c1-4-34-26(33)22-16(2)23(29-17(22)3)25(32)30-13-7-8-19(15-30)24(31)27-12-11-18-14-28-21-10-6-5-9-20(18)21/h5-6,9-10,14,19,28-29H,4,7-8,11-13,15H2,1-3H3,(H,27,31)/t19-/m0/s1

InChI Key

YRBBENOGRIOSMD-IBGZPJMESA-N

MDL Number (MFCD)

MFCD27178835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

464.56

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.845

Distribution Coefficient, logD

2.845

Water Solubility, LogSw

-2.95

Polar Surface Area

82.681

Acid Dissociation Constant (pKa)

5.30

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.30

F602-0888 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

SmartTM Library (51161 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F602-0888 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F602-0888?
Check Price and Availability of F602-0888, 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 F602-0888 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F602-0888
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F602-0888
  • 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 F602-0888 available by request