V008-7090 Screening compound: ETHYL 4-{[4-ETHOXY-1-(3-PHENYLPROPYL)-1H-INDOL-2-YL]CARBONYL}TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE

V008-7090 Screening compound: ETHYL 4-{[4-ETHOXY-1-(3-PHENYLPROPYL)-1H-INDOL-2-YL]CARBONYL}TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE
V008-7090 Screening compound: ETHYL 4-{[4-ETHOXY-1-(3-PHENYLPROPYL)-1H-INDOL-2-YL]CARBONYL}TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE alternative view

Chemical Structure Depiction of ChemDiv screening compound V008-7090
ETHYL 4-{[4-ETHOXY-1-(3-PHENYLPROPYL)-1H-INDOL-2-YL]CARBONYL}TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE

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

V008-7090

Molecular Formula

C27H33N3O4 (C27 H33 N3 O4)

Compound Name

ETHYL 4-{[4-ETHOXY-1-(3-PHENYLPROPYL)-1H-INDOL-2-YL]CARBONYL}TETRAHYDRO-1(2H)-PYRAZINECARBOXYLATE

IUPAC name

n/a

SMILES

CCOC(N(CC1)CCN1C(c1cc(c(OCC)ccc2)c2n1CCCc1ccccc1)=O)=O

InChI

InChI=1S/C27H33N3O4/c1-3-33-25-14-8-13-23-22(25)20-24(30(23)15-9-12-21-10-6-5-7-11-21)26(31)28-16-18-29(19-17-28)27(32)34-4-2/h5-8,10-11,13-14,20H,3-4,9,12,15-19H2,1-2H3

InChI Key

MJAQOHDPURNPJL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19858578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.270

Distribution Coefficient, logD

5.270

Water Solubility, LogSw

-5.33

Polar Surface Area

47.310

Acid Dissociation Constant (pKa)

24.82

Base Dissociation Constant (pKb)

2.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V008-7090 in Drug Discovery

Included in Screening Libraries

Indole Derivatives (10091 compounds)

Anti-HIV1 Library (19540 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 V008-7090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V008-7090?
Check Price and Availability of V008-7090, 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 V008-7090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V008-7090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V008-7090
  • 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 V008-7090 available by request