E634-1427 Screening compound: 2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide

E634-1427 Screening compound: 2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide
E634-1427 Screening compound: 2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E634-1427
2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylethyl)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

E634-1427

Molecular Formula

C26H25N5O2S (C26 H25 N5 O2 S)

Compound Name

2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide

IUPAC name

2-[(5-{4-methyl-4H-furo[32-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-124-triazol-3-yl)sulfanyl]-N-(2-phenylethyl)acetamide

SMILES

Cc(cccc1)c1-n1c(SCC(NCCc2ccccc2)=O)nnc1-c1cc(occ2)c2n1C

InChI

InChI=1S/C26H25N5O2S/c1-18-8-6-7-11-20(18)31-25(22-16-23-21(30(22)2)13-15-33-23)28-29-26(31)34-17-24(32)27-14-12-19-9-4-3-5-10-19/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,27,32)

InChI Key

GMOOCNSEZPDGJW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14905836

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.841

Distribution Coefficient, logD

3.841

Water Solubility, LogSw

-3.93

Polar Surface Area

58.732

Acid Dissociation Constant (pKa)

14.75

Base Dissociation Constant (pKb)

1.19

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.20

E634-1427 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E634-1427 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E634-1427?
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What is the minimum amount of E634-1427 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E634-1427
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E634-1427
  • 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 E634-1427 available by request