F750-0199 Screening compound: N~1~-(2-chloro-4-fluorobenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide

F750-0199 Screening compound: N~1~-(2-chloro-4-fluorobenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide
F750-0199 Screening compound: N~1~-(2-chloro-4-fluorobenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F750-0199
N~1~-(2-chloro-4-fluorobenzyl)-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

F750-0199

Molecular Formula

C19H14ClFN4OS (C19 H14 ClFN4 OS)

Compound Name

N~1~-(2-chloro-4-fluorobenzyl)-2-(pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6-ylsulfanyl)acetamide

IUPAC name

N-[(2-chloro-4-fluorophenyl)methyl]-2-{2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)357911-hexaen-7-ylsulfanyl}acetamide

SMILES

O=C(CSc1nc2ncccc2n2c1ccc2)NCc(ccc(F)c1)c1Cl

InChI

InChI=1S/C19H14ClFN4OS/c20-14-9-13(21)6-5-12(14)10-23-17(26)11-27-19-16-4-2-8-25(16)15-3-1-7-22-18(15)24-19/h1-9H,10-11H2,(H,23,26)

InChI Key

YIJHNRYUNCPYME-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14965811

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.86

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.055

Distribution Coefficient, logD

4.049

Water Solubility, LogSw

-4.34

Polar Surface Area

42.478

Acid Dissociation Constant (pKa)

12.81

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.53

F750-0199 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 F750-0199 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F750-0199?
Check Price and Availability of F750-0199, 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 F750-0199 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F750-0199
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F750-0199
  • 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 F750-0199 available by request