P719-1104 Screening compound: N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide

P719-1104 Screening compound: N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide
P719-1104 Screening compound: N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P719-1104
N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide

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

P719-1104

Molecular Formula

C18H22ClN3O4S (C18 H22 ClN3 O4 S)

Compound Name

N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-1H,2H,3H,4H-pyrrolo[1,2-a]pyrazine-7-sulfonamide

IUPAC name

N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropyl)-1-oxo-1H2H3H4H-pyrrolo[12-a]pyrazine-7-sulfonamide

SMILES

CC(C)CN(CCn1c2cc(S(Nc(cc3)cc(Cl)c3OC)(=O)=O)c1)C2=O

InChI

InChI=1S/C18H22ClN3O4S/c1-12(2)10-22-7-6-21-11-14(9-16(21)18(22)23)27(24,25)20-13-4-5-17(26-3)15(19)8-13/h4-5,8-9,11-12,20H,6-7,10H2,1-3H3

InChI Key

WVHDLDQQVVDBOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27613995

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

411.91

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.031

Distribution Coefficient, logD

2.853

Water Solubility, LogSw

-3.47

Polar Surface Area

67.530

Acid Dissociation Constant (pKa)

7.70

Base Dissociation Constant (pKb)

-2.28

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

P719-1104 in Drug Discovery

Included in Screening Libraries

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

Hsp90-Targeted Library (11355 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with P719-1104 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P719-1104?
Check Price and Availability of P719-1104, 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 P719-1104 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P719-1104
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P719-1104
  • 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 P719-1104 available by request