V012-6969 Screening compound: N~2~-[1-(cyclopropylcarbonyl)-4-piperidyl]-3-[(2,4-difluorobenzoyl)amino]-2-pyrazinecarboxamide

V012-6969 Screening compound: N~2~-[1-(cyclopropylcarbonyl)-4-piperidyl]-3-[(2,4-difluorobenzoyl)amino]-2-pyrazinecarboxamide
V012-6969 Screening compound: N~2~-[1-(cyclopropylcarbonyl)-4-piperidyl]-3-[(2,4-difluorobenzoyl)amino]-2-pyrazinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V012-6969
N~2~-[1-(cyclopropylcarbonyl)-4-piperidyl]-3-[(2,4-difluorobenzoyl)amino]-2-pyrazinecarboxamide

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

V012-6969

Molecular Formula

C21H21F2N5O3 (C21 H21 F2 N5 O3)

Compound Name

N~2~-[1-(cyclopropylcarbonyl)-4-piperidyl]-3-[(2,4-difluorobenzoyl)amino]-2-pyrazinecarboxamide

IUPAC name

N-(1-cyclopropanecarbonylpiperidin-4-yl)-3-(24-difluorobenzamido)pyrazine-2-carboxamide

SMILES

O=C(C1CC1)N(CC1)CCC1NC(c1nccnc1NC(c(ccc(F)c1)c1F)=O)=O

InChI

InChI=1S/C21H21F2N5O3/c22-13-3-4-15(16(23)11-13)19(29)27-18-17(24-7-8-25-18)20(30)26-14-5-9-28(10-6-14)21(31)12-1-2-12/h3-4,7-8,11-12,14H,1-2,5-6,9-10H2,(H,26,30)(H,25,27,29)

InChI Key

WRWTXEXJDDPCEA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19906909

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

429.43

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.587

Distribution Coefficient, logD

-1.176

Water Solubility, LogSw

-2.27

Polar Surface Area

83.953

Acid Dissociation Constant (pKa)

4.64

Base Dissociation Constant (pKb)

7.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

V012-6969 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Anti-HIV1 Library (19540 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with V012-6969 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V012-6969?
Check Price and Availability of V012-6969, 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 V012-6969 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V012-6969
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V012-6969
  • 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 V012-6969 available by request