E635-0146 Screening compound: 1-(5-chloro-2-methoxyphenyl)-3-{1-[6-methyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]propyl}urea

E635-0146 Screening compound: 1-(5-chloro-2-methoxyphenyl)-3-{1-[6-methyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]propyl}urea
E635-0146 Screening compound: 1-(5-chloro-2-methoxyphenyl)-3-{1-[6-methyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]propyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E635-0146
1-(5-chloro-2-methoxyphenyl)-3-{1-[6-methyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]propyl}urea

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

E635-0146

Molecular Formula

C23H27ClN4O2S (C23 H27 ClN4 O2 S)

Compound Name

1-(5-chloro-2-methoxyphenyl)-3-{1-[6-methyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]propyl}urea

IUPAC name

1-(5-chloro-2-methoxyphenyl)-3-{1-[6-methyl-2-(1H-pyrrol-1-yl)-4H5H6H7H-thieno[23-c]pyridin-3-yl]propyl}urea

SMILES

CCC(c1c(-n2cccc2)sc2c1CCN(C)C2)NC(Nc(cc(cc1)Cl)c1OC)=O

InChI

InChI=1S/C23H27ClN4O2S/c1-4-17(25-23(29)26-18-13-15(24)7-8-19(18)30-3)21-16-9-12-27(2)14-20(16)31-22(21)28-10-5-6-11-28/h5-8,10-11,13,17H,4,9,12,14H2,1-3H3,(H2,25,26,29)/t17-/m0/s1

InChI Key

BSTLHZQINILQCA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14905932

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.01

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.605

Distribution Coefficient, logD

2.045

Water Solubility, LogSw

-4.74

Polar Surface Area

48.812

Acid Dissociation Constant (pKa)

10.92

Base Dissociation Constant (pKb)

9.96

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

34.80

E635-0146 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Purinergic Library (3321 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
  • Cardiovascular
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E635-0146 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E635-0146?
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What is the minimum amount of E635-0146 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E635-0146
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E635-0146
  • 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 E635-0146 available by request