V011-1154 Screening compound: ethyl 4-{[3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl]carbonyl}tetrahydro-1(2H)-pyrazinecarboxylate

V011-1154 Screening compound: ethyl 4-{[3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl]carbonyl}tetrahydro-1(2H)-pyrazinecarboxylate
V011-1154 Screening compound: ethyl 4-{[3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl]carbonyl}tetrahydro-1(2H)-pyrazinecarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound V011-1154
ethyl 4-{[3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-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

V011-1154

Molecular Formula

C29H35F3N4O4 (C29 H35 F3 N4 O4)

Compound Name

ethyl 4-{[3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinolin-5-yl]carbonyl}tetrahydro-1(2H)-pyrazinecarboxylate

IUPAC name

n/a

SMILES

CCOC(N(CC1)CCN1C(C(C1)C(CN(CCOc2ccccc2)CC2)N2c2c1cc(C(F)(F)F)cc2)=O)=O

InChI

InChI=1S/C29H35F3N4O4/c1-2-39-28(38)35-13-11-34(12-14-35)27(37)24-19-21-18-22(29(30,31)32)8-9-25(21)36-15-10-33(20-26(24)36)16-17-40-23-6-4-3-5-7-23/h3-9,18,24,26H,2,10-17,19-20H2,1H3

InChI Key

BJDVBVVWUZQQOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19853387

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

560.62

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.491

Distribution Coefficient, logD

3.780

Water Solubility, LogSw

-4.26

Polar Surface Area

52.908

Acid Dissociation Constant (pKa)

22.94

Base Dissociation Constant (pKb)

8.02

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

51.70

References: we are preparing a list of scientific research reports with V011-1154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V011-1154?
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What is the minimum amount of V011-1154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V011-1154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V011-1154
  • 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 V011-1154 available by request