F634-0285 Screening compound: N-[(4-ethoxyphenyl)methyl]-1-(1-methyl-1H-1,2,3-benzotriazole-5-carbonyl)piperidine-4-carboxamide

F634-0285 Screening compound: N-[(4-ethoxyphenyl)methyl]-1-(1-methyl-1H-1,2,3-benzotriazole-5-carbonyl)piperidine-4-carboxamide
F634-0285 Screening compound: N-[(4-ethoxyphenyl)methyl]-1-(1-methyl-1H-1,2,3-benzotriazole-5-carbonyl)piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F634-0285
N-[(4-ethoxyphenyl)methyl]-1-(1-methyl-1H-1,2,3-benzotriazole-5-carbonyl)piperidine-4-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

F634-0285

Molecular Formula

C23H27N5O3 (C23 H27 N5 O3)

Compound Name

N-[(4-ethoxyphenyl)methyl]-1-(1-methyl-1H-1,2,3-benzotriazole-5-carbonyl)piperidine-4-carboxamide

IUPAC name

N-[(4-ethoxyphenyl)methyl]-1-(1-methyl-1H-123-benzotriazole-5-carbonyl)piperidine-4-carboxamide

SMILES

CCOc1ccc(CNC(C(CC2)CCN2C(c(cc2)cc3c2n(C)nn3)=O)=O)cc1

InChI

InChI=1S/C23H27N5O3/c1-3-31-19-7-4-16(5-8-19)15-24-22(29)17-10-12-28(13-11-17)23(30)18-6-9-21-20(14-18)25-26-27(21)2/h4-9,14,17H,3,10-13,15H2,1-2H3,(H,24,29)

InChI Key

VICXIVALBUQIFO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14961332

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.344

Distribution Coefficient, logD

1.344

Water Solubility, LogSw

-2.24

Polar Surface Area

74.407

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

2.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

F634-0285 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CORONAVIRUS Library (20774 compounds)

PLpro Library (6343 compounds)

Indoleamine 2,3-dioxygenase 1 Focused Library (5816 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with F634-0285 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F634-0285?
Check Price and Availability of F634-0285, 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 F634-0285 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F634-0285
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F634-0285
  • 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 F634-0285 available by request