V002-2066 Screening compound: ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(2-ethoxybenzamido)-1H-indol-1-yl)acetate

V002-2066 Screening compound: ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(2-ethoxybenzamido)-1H-indol-1-yl)acetate
V002-2066 Screening compound: ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(2-ethoxybenzamido)-1H-indol-1-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-2066
ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(2-ethoxybenzamido)-1H-indol-1-yl)acetate

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

V002-2066

Molecular Formula

C30H35N3O6 (C30 H35 N3 O6)

Compound Name

ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(2-ethoxybenzamido)-1H-indol-1-yl)acetate

IUPAC name

ethyl 2-(3-{[(cyclopropylmethyl)(propyl)carbamoyl]carbonyl}-5-(2-ethoxybenzamido)-1H-indol-1-yl)acetate

SMILES

CCCN(CC1CC1)C(C(c1cn(CC(OCC)=O)c(cc2)c1cc2NC(c(cccc1)c1OCC)=O)=O)=O

InChI

InChI=1S/C30H35N3O6/c1-4-15-32(17-20-11-12-20)30(37)28(35)24-18-33(19-27(34)39-6-3)25-14-13-21(16-23(24)25)31-29(36)22-9-7-8-10-26(22)38-5-2/h7-10,13-14,16,18,20H,4-6,11-12,15,17,19H2,1-3H3,(H,31,36)

InChI Key

RLBSTCUWDZCZHZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19946651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

533.62

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

16.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.697

Distribution Coefficient, logD

4.695

Water Solubility, LogSw

-4.24

Polar Surface Area

83.154

Acid Dissociation Constant (pKa)

9.82

Base Dissociation Constant (pKb)

3.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

V002-2066 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Anti-HIV1 Library (19540 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Structure:
  • Cyclic compounds
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V002-2066 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-2066?
Check Price and Availability of V002-2066, 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 V002-2066 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-2066
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-2066
  • 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 V002-2066 available by request