F348-0467 Screening compound: ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]1-methyl-1H-imidazole-4-sulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

F348-0467 Screening compound: ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]1-methyl-1H-imidazole-4-sulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
F348-0467 Screening compound: ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]1-methyl-1H-imidazole-4-sulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound F348-0467
ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]1-methyl-1H-imidazole-4-sulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

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

F348-0467

Molecular Formula

C22H26N4O6S (C22 H26 N4 O6 S)

Compound Name

ethyl 5-({N-[(2H-1,3-benzodioxol-5-yl)methyl]1-methyl-1H-imidazole-4-sulfonamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate

IUPAC name

ethyl 5-({N-[(2H-13-benzodioxol-5-yl)methyl]1-methyl-1H-imidazole-4-sulfonamido}methyl)-24-dimethyl-1H-pyrrole-3-carboxylate

SMILES

CCOC(c1c(C)[nH]c(CN(Cc(cc2)cc3c2OCO3)S(c2cn(C)cn2)(=O)=O)c1C)=O

InChI

InChI=1S/C22H26N4O6S/c1-5-30-22(27)21-14(2)17(24-15(21)3)10-26(33(28,29)20-11-25(4)12-23-20)9-16-6-7-18-19(8-16)32-13-31-18/h6-8,11-12,24H,5,9-10,13H2,1-4H3

InChI Key

XPCXGYSOPVRTJH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14951480

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

474.54

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.335

Distribution Coefficient, logD

2.335

Water Solubility, LogSw

-2.93

Polar Surface Area

93.099

Acid Dissociation Constant (pKa)

16.72

Base Dissociation Constant (pKb)

-1.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.40

F348-0467 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Protein Arginine Methyltransferases Library (27925 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with F348-0467 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F348-0467?
Check Price and Availability of F348-0467, 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 F348-0467 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F348-0467
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F348-0467
  • 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 F348-0467 available by request