V002-7293 Screening compound: 3-(4-methoxyphenyl)-N-[2-(2-methoxyphenyl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

V002-7293 Screening compound: 3-(4-methoxyphenyl)-N-[2-(2-methoxyphenyl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide
V002-7293 Screening compound: 3-(4-methoxyphenyl)-N-[2-(2-methoxyphenyl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V002-7293
3-(4-methoxyphenyl)-N-[2-(2-methoxyphenyl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

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

V002-7293

Molecular Formula

C30H32F3N3O3 (C30 H32 F3 N3 O3)

Compound Name

3-(4-methoxyphenyl)-N-[2-(2-methoxyphenyl)ethyl]-8-(trifluoromethyl)-1H,2H,3H,4H,4aH,5H,6H-pyrazino[1,2-a]quinoline-5-carboxamide

IUPAC name

3-(4-methoxyphenyl)-N-[2-(2-methoxyphenyl)ethyl]-8-(trifluoromethyl)-1H2H3H4H4aH5H6H-pyrazino[12-a]quinoline-5-carboxamide

SMILES

COc(cc1)ccc1N(CC1)CC(C(C2)C(NCCc(cccc3)c3OC)=O)N1c1c2cc(C(F)(F)F)cc1

InChI

InChI=1S/C30H32F3N3O3/c1-38-24-10-8-23(9-11-24)35-15-16-36-26-12-7-22(30(31,32)33)17-21(26)18-25(27(36)19-35)29(37)34-14-13-20-5-3-4-6-28(20)39-2/h3-12,17,25,27H,13-16,18-19H2,1-2H3,(H,34,37)

InChI Key

GJACEAALZQFBOO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19848395

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

539.6

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.731

Distribution Coefficient, logD

5.728

Water Solubility, LogSw

-5.22

Polar Surface Area

45.232

Acid Dissociation Constant (pKa)

13.12

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

36.70

References: we are preparing a list of scientific research reports with V002-7293 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V002-7293?
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What is the minimum amount of V002-7293 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V002-7293
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V002-7293
  • 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 V002-7293 available by request