E634-1401 Screening compound: N-(3-ethylphenyl)-2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of ChemDiv screening compound E634-1401
N-(3-ethylphenyl)-2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]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
E634-1401
Molecular Formula
C26H25N5O2S (C26 H25 N5 O2 S)
Compound Name
N-(3-ethylphenyl)-2-[(5-{4-methyl-4H-furo[3,2-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
IUPAC name
N-(3-ethylphenyl)-2-[(5-{4-methyl-4H-furo[32-b]pyrrol-5-yl}-4-(2-methylphenyl)-4H-124-triazol-3-yl)sulfanyl]acetamide
SMILES
CCc1cccc(NC(CSc2nnc(-c3cc(occ4)c4n3C)n2-c2c(C)cccc2)=O)c1
InChI Key
MDL Number (MFCD)
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
8.00
Number of Nitrogen and Oxygen Atoms
7
Partition Coefficient, logP
5.175
Distribution Coefficient, logD
5.175
Water Solubility, LogSw
-5.00
Polar Surface Area
57.568
Acid Dissociation Constant (pKa)
13.09
Base Dissociation Constant (pKb)
1.18
Number of Chiral Centers
0.00
Percent sp3 carbon bonding
19.20
E634-1401 in Drug Discovery
Included in Screening Libraries
Human Proteases Annotated Library (2868 compounds)
Selective Target Activity Profiling Library (14702 compounds)
ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)
Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)
Included in 1.7M Stock Database
- Cancer
- Nervous system
- Male
- Female
- Hemic and lymphatic
- Skin
- Endocrine
- Phosphatases
References: we are preparing a list of scientific research reports with E634-1401 chemical compound. It will be published here after verification.
Frequently Asked Questions
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Available from 1 mg in Glass Vials or 96-tube racks.
ChemDiv sends parcels with Express services (UPS, WC).
- 1–2 days for small orders
- 2–4 weeks for large selections
- 0.5–50 mg of dry powder sample in single glass vials, custom vials
- DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)