E635-0661 Screening compound: 1-(3-chloro-4-methylphenyl)-3-{[6-ethyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]methyl}urea

E635-0661 Screening compound: 1-(3-chloro-4-methylphenyl)-3-{[6-ethyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]methyl}urea
E635-0661 Screening compound: 1-(3-chloro-4-methylphenyl)-3-{[6-ethyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]methyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E635-0661
1-(3-chloro-4-methylphenyl)-3-{[6-ethyl-2-(1H-pyrrol-1-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridin-3-yl]methyl}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

E635-0661

Molecular Formula

C22H25ClN4OS (C22 H25 ClN4 OS)

Compound Name

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

IUPAC name

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

SMILES

CCN(CC1)Cc2c1c(CNC(Nc1cc(Cl)c(C)cc1)=O)c(-n1cccc1)s2

InChI

InChI=1S/C22H25ClN4OS/c1-3-26-11-8-17-18(21(29-20(17)14-26)27-9-4-5-10-27)13-24-22(28)25-16-7-6-15(2)19(23)12-16/h4-7,9-10,12H,3,8,11,13-14H2,1-2H3,(H2,24,25,28)

InChI Key

YYFKJEWHNTWVTL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14906025

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.99

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.759

Distribution Coefficient, logD

3.844

Water Solubility, LogSw

-5.93

Polar Surface Area

42.309

Acid Dissociation Constant (pKa)

11.80

Base Dissociation Constant (pKb)

9.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

References: we are preparing a list of scientific research reports with E635-0661 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of E635-0661 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E635-0661
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E635-0661
  • 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 E635-0661 available by request