F345-1030 Screening compound: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N~1~-(4-methylphenyl)tetrahydro-1(2H)-pyridinecarboxamide

F345-1030 Screening compound: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N~1~-(4-methylphenyl)tetrahydro-1(2H)-pyridinecarboxamide
F345-1030 Screening compound: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N~1~-(4-methylphenyl)tetrahydro-1(2H)-pyridinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F345-1030
4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N~1~-(4-methylphenyl)tetrahydro-1(2H)-pyridinecarboxamide

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

F345-1030

Molecular Formula

C22H25N3O4 (C22 H25 N3 O4)

Compound Name

4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-N~1~-(4-methylphenyl)tetrahydro-1(2H)-pyridinecarboxamide

IUPAC name

n/a

SMILES

Cc(cc1)ccc1NC(N1CCC(CC(Nc(cc2)cc3c2OCO3)=O)CC1)=O

InChI

InChI=1S/C22H25N3O4/c1-15-2-4-17(5-3-15)24-22(27)25-10-8-16(9-11-25)12-21(26)23-18-6-7-19-20(13-18)29-14-28-19/h2-7,13,16H,8-12,14H2,1H3,(H,23,26)(H,24,27)

InChI Key

RHEZCNOZNHXGMR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14951267

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.829

Distribution Coefficient, logD

3.829

Water Solubility, LogSw

-3.94

Polar Surface Area

65.701

Acid Dissociation Constant (pKa)

11.02

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

F345-1030 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F345-1030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F345-1030?
Check Price and Availability of F345-1030, 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 F345-1030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F345-1030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F345-1030
  • 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 F345-1030 available by request