V016-9517 Screening compound: N-{[5-benzyl-1-(4-fluorophenyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-2-methyl-N-(propan-2-yl)propanamide

V016-9517 Screening compound: N-{[5-benzyl-1-(4-fluorophenyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-2-methyl-N-(propan-2-yl)propanamide
V016-9517 Screening compound: N-{[5-benzyl-1-(4-fluorophenyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-2-methyl-N-(propan-2-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V016-9517
N-{[5-benzyl-1-(4-fluorophenyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-2-methyl-N-(propan-2-yl)propanamide

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

V016-9517

Molecular Formula

C27H33FN4O (C27 H33 FN4 O)

Compound Name

N-{[5-benzyl-1-(4-fluorophenyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridin-3-yl]methyl}-2-methyl-N-(propan-2-yl)propanamide

IUPAC name

N-{[5-benzyl-1-(4-fluorophenyl)-1H4H5H6H7H-pyrazolo[43-c]pyridin-3-yl]methyl}-2-methyl-N-(propan-2-yl)propanamide

SMILES

CC(C)C(N(Cc(c1c2CCN(Cc3ccccc3)C1)nn2-c(cc1)ccc1F)C(C)C)=O

InChI

InChI=1S/C27H33FN4O/c1-19(2)27(33)31(20(3)4)18-25-24-17-30(16-21-8-6-5-7-9-21)15-14-26(24)32(29-25)23-12-10-22(28)11-13-23/h5-13,19-20H,14-18H2,1-4H3

InChI Key

ZXADLOZGCGIVIP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19862238

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

448.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.708

Distribution Coefficient, logD

1.061

Water Solubility, LogSw

-4.35

Polar Surface Area

34.951

Acid Dissociation Constant (pKa)

22.71

Base Dissociation Constant (pKb)

11.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.70

V016-9517 in Drug Discovery

Included in Screening Libraries

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with V016-9517 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V016-9517?
Check Price and Availability of V016-9517, 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 V016-9517 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V016-9517
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V016-9517
  • 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 V016-9517 available by request