E207-1571 Screening compound: N~3~-{2-[butyl(2-furylmethyl)amino]ethyl}-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-thiochromeno[4,3-c]pyrazole-3-carboxamide

E207-1571 Screening compound: N~3~-{2-[butyl(2-furylmethyl)amino]ethyl}-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-thiochromeno[4,3-c]pyrazole-3-carboxamide
E207-1571 Screening compound: N~3~-{2-[butyl(2-furylmethyl)amino]ethyl}-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-thiochromeno[4,3-c]pyrazole-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E207-1571
N~3~-{2-[butyl(2-furylmethyl)amino]ethyl}-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-thiochromeno[4,3-c]pyrazole-3-carboxamide

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

E207-1571

Molecular Formula

C23H28N4O4S (C23 H28 N4 O4 S)

Compound Name

N~3~-{2-[butyl(2-furylmethyl)amino]ethyl}-1-methyl-5,5-dioxo-4,5-dihydro-1H-5lambda~6~-thiochromeno[4,3-c]pyrazole-3-carboxamide

IUPAC name

N-(2-{butyl[(furan-2-yl)methyl]amino}ethyl)-1-methyl-55-dioxo-1H4H-5lambda6-thiochromeno[43-c]pyrazole-3-carboxamide

SMILES

CCCCN(CCNC(c1nn(C)c(-c2c3cccc2)c1CS3(=O)=O)=O)Cc1ccco1

InChI

InChI=1S/C23H28N4O4S/c1-3-4-12-27(15-17-8-7-14-31-17)13-11-24-23(28)21-19-16-32(29,30)20-10-6-5-9-18(20)22(19)26(2)25-21/h5-10,14H,3-4,11-13,15-16H2,1-2H3,(H,24,28)

InChI Key

VYAIHUVETMFIPD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14846430

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

456.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.496

Distribution Coefficient, logD

2.306

Water Solubility, LogSw

-3.01

Polar Surface Area

79.031

Acid Dissociation Constant (pKa)

13.31

Base Dissociation Constant (pKb)

7.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

E207-1571 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Library (67538 compounds)

Aurora A-B Kinases Targeted Library (9426 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E207-1571 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E207-1571?
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What is the minimum amount of E207-1571 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E207-1571
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E207-1571
  • 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 E207-1571 available by request