V014-5699 Screening compound: N-(3-METHYLBUTYL)-3-[2-(MORPHOLIN-4-YL)-2-OXOETHYL]-8-(TRIFLUOROMETHYL)-1H,2H,3H,4H,4AH,5H,6H-PYRAZINO[1,2-A]QUINOLINE-5-CARBOXAMIDE

V014-5699 Screening compound: N-(3-METHYLBUTYL)-3-[2-(MORPHOLIN-4-YL)-2-OXOETHYL]-8-(TRIFLUOROMETHYL)-1H,2H,3H,4H,4AH,5H,6H-PYRAZINO[1,2-A]QUINOLINE-5-CARBOXAMIDE
V014-5699 Screening compound: N-(3-METHYLBUTYL)-3-[2-(MORPHOLIN-4-YL)-2-OXOETHYL]-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 V014-5699
N-(3-METHYLBUTYL)-3-[2-(MORPHOLIN-4-YL)-2-OXOETHYL]-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

V014-5699

Molecular Formula

C25H35F3N4O3 (C25 H35 F3 N4 O3)

Compound Name

N-(3-METHYLBUTYL)-3-[2-(MORPHOLIN-4-YL)-2-OXOETHYL]-8-(TRIFLUOROMETHYL)-1H,2H,3H,4H,4AH,5H,6H-PYRAZINO[1,2-A]QUINOLINE-5-CARBOXAMIDE

IUPAC name

n/a

SMILES

CC(C)CCNC(C(C1)C(CN(CC(N2CCOCC2)=O)CC2)N2c2c1cc(C(F)(F)F)cc2)=O

InChI

InChI=1S/C25H35F3N4O3/c1-17(2)5-6-29-24(34)20-14-18-13-19(25(26,27)28)3-4-21(18)32-8-7-30(15-22(20)32)16-23(33)31-9-11-35-12-10-31/h3-4,13,17,20,22H,5-12,14-16H2,1-2H3,(H,29,34)

InChI Key

NTEWPKZEVIJGTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19853397

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

496.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.480

Distribution Coefficient, logD

2.428

Water Solubility, LogSw

-2.94

Polar Surface Area

54.911

Acid Dissociation Constant (pKa)

12.94

Base Dissociation Constant (pKb)

6.51

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

68.00

V014-5699 in Drug Discovery

Included in Screening Libraries

Bromodomain Modulators Library (5801 compounds)

PI3K-Targeted Library (17255 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with V014-5699 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V014-5699?
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What is the minimum amount of V014-5699 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V014-5699
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V014-5699
  • 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 V014-5699 available by request