S650-1627 Screening compound: methyl 2-{[4-(4-chlorophenyl)-1-ethyl-1H-pyrrol-2-yl]formamido}acetate

S650-1627 Screening compound: methyl 2-{[4-(4-chlorophenyl)-1-ethyl-1H-pyrrol-2-yl]formamido}acetate
S650-1627 Screening compound: methyl 2-{[4-(4-chlorophenyl)-1-ethyl-1H-pyrrol-2-yl]formamido}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound S650-1627
methyl 2-{[4-(4-chlorophenyl)-1-ethyl-1H-pyrrol-2-yl]formamido}acetate

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

S650-1627

Molecular Formula

C16H17ClN2O3 (C16 H17 ClN2 O3)

Compound Name

methyl 2-{[4-(4-chlorophenyl)-1-ethyl-1H-pyrrol-2-yl]formamido}acetate

IUPAC name

methyl 2-{[4-(4-chlorophenyl)-1-ethyl-1H-pyrrol-2-yl]formamido}acetate

SMILES

CCn1c(C(NCC(OC)=O)=O)cc(-c(cc2)ccc2Cl)c1

InChI

InChI=1S/C16H17ClN2O3/c1-3-19-10-12(11-4-6-13(17)7-5-11)8-14(19)16(21)18-9-15(20)22-2/h4-8,10H,3,9H2,1-2H3,(H,18,21)

InChI Key

FPNCMLLZDHKIMI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29018534

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.089

Distribution Coefficient, logD

3.089

Water Solubility, LogSw

-3.68

Polar Surface Area

46.709

Acid Dissociation Constant (pKa)

13.68

Base Dissociation Constant (pKb)

-2.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

S650-1627 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with S650-1627 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S650-1627?
Check Price and Availability of S650-1627, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of S650-1627 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S650-1627
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S650-1627
  • 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 S650-1627 available by request