F646-0803 Screening compound: N~1~-[3-(1-azepanyl)propyl]-2-methyl-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide

F646-0803 Screening compound: N~1~-[3-(1-azepanyl)propyl]-2-methyl-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide
F646-0803 Screening compound: N~1~-[3-(1-azepanyl)propyl]-2-methyl-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F646-0803
N~1~-[3-(1-azepanyl)propyl]-2-methyl-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide

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

F646-0803

Molecular Formula

C22H28N6O (C22 H28 N6 O)

Compound Name

N~1~-[3-(1-azepanyl)propyl]-2-methyl-3-(3H-[1,2,3]triazolo[4,5-b]pyridin-3-yl)benzamide

IUPAC name

n/a

SMILES

Cc(c(-n1nnc2cccnc12)ccc1)c1C(NCCCN1CCCCCC1)=O

InChI

InChI=1S/C22H28N6O/c1-17-18(22(29)24-13-8-16-27-14-4-2-3-5-15-27)9-6-11-20(17)28-21-19(25-26-28)10-7-12-23-21/h6-7,9-12H,2-5,8,13-16H2,1H3,(H,24,29)

InChI Key

SGFCPXXFDHGORO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27182386

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.646

Distribution Coefficient, logD

0.075

Water Solubility, LogSw

-3.23

Polar Surface Area

63.975

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

9.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

References: we are preparing a list of scientific research reports with F646-0803 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F646-0803?
Check Price and Availability of F646-0803, 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 F646-0803 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F646-0803
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F646-0803
  • 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 F646-0803 available by request