6554-3356 Screening compound: (4-chlorophenyl)methyl 2-{2-[(4-methoxyphenyl)formamido]acetamido}acetate

6554-3356 Screening compound: (4-chlorophenyl)methyl 2-{2-[(4-methoxyphenyl)formamido]acetamido}acetate
6554-3356 Screening compound: (4-chlorophenyl)methyl 2-{2-[(4-methoxyphenyl)formamido]acetamido}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6554-3356
(4-chlorophenyl)methyl 2-{2-[(4-methoxyphenyl)formamido]acetamido}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

6554-3356

Molecular Formula

C19H19ClN2O5 (C19 H19 ClN2 O5)

Compound Name

(4-chlorophenyl)methyl 2-{2-[(4-methoxyphenyl)formamido]acetamido}acetate

IUPAC name

(4-chlorophenyl)methyl 2-{2-[(4-methoxyphenyl)formamido]acetamido}acetate

SMILES

COc(cc1)ccc1C(NCC(NCC(OCc(cc1)ccc1Cl)=O)=O)=O

InChI

InChI=1S/C19H19ClN2O5/c1-26-16-8-4-14(5-9-16)19(25)22-10-17(23)21-11-18(24)27-12-13-2-6-15(20)7-3-13/h2-9H,10-12H2,1H3,(H,21,23)(H,22,25)

InChI Key

JETITVWASWXIHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03719096

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

390.82

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.117

Distribution Coefficient, logD

3.117

Water Solubility, LogSw

-3.55

Polar Surface Area

77.201

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

-2.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

6554-3356 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 6554-3356 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6554-3356?
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What is the minimum amount of 6554-3356 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6554-3356
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6554-3356
  • 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 6554-3356 available by request