F750-0097 Screening compound: N-(3-methoxybenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide

F750-0097 Screening compound: N-(3-methoxybenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide
F750-0097 Screening compound: N-(3-methoxybenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F750-0097
N-(3-methoxybenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide

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

F750-0097

Molecular Formula

C20H18N4O2S (C20 H18 N4 O2 S)

Compound Name

N-(3-methoxybenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-2-{2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)357911-hexaen-7-ylsulfanyl}acetamide

SMILES

COc1cccc(CNC(CSc2nc3ncccc3n3c2ccc3)=O)c1

InChI

InChI=1S/C20H18N4O2S/c1-26-15-6-2-5-14(11-15)12-22-18(25)13-27-20-17-8-4-10-24(17)16-7-3-9-21-19(16)23-20/h2-11H,12-13H2,1H3,(H,22,25)

InChI Key

SAILBEVYDJPFKZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14965800

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.129

Distribution Coefficient, logD

3.123

Water Solubility, LogSw

-3.32

Polar Surface Area

50.022

Acid Dissociation Constant (pKa)

13.74

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

F750-0097 in Drug Discovery

Included in Screening Libraries

Immunological Library (6760 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • 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 F750-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F750-0097?
Check Price and Availability of F750-0097, 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 F750-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F750-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F750-0097
  • 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 F750-0097 available by request