G571-0226 Screening compound: methyl 4-[({2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl}carbamoyl)formamido]benzoate

G571-0226 Screening compound: methyl 4-[({2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl}carbamoyl)formamido]benzoate
G571-0226 Screening compound: methyl 4-[({2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl}carbamoyl)formamido]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound G571-0226
methyl 4-[({2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl}carbamoyl)formamido]benzoate

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

G571-0226

Molecular Formula

C21H18ClN3O4S (C21 H18 ClN3 O4 S)

Compound Name

methyl 4-[({2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl}carbamoyl)formamido]benzoate

IUPAC name

methyl 4-[({2-[2-(4-chlorophenyl)-13-thiazol-4-yl]ethyl}carbamoyl)formamido]benzoate

SMILES

COC(c(cc1)ccc1NC(C(NCCc1csc(-c(cc2)ccc2Cl)n1)=O)=O)=O

InChI

InChI=1S/C21H18ClN3O4S/c1-29-21(28)14-4-8-16(9-5-14)24-19(27)18(26)23-11-10-17-12-30-20(25-17)13-2-6-15(22)7-3-13/h2-9,12H,10-11H2,1H3,(H,23,26)(H,24,27)

InChI Key

WPTBSJKFQHEHCG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07803078

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.91

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.121

Distribution Coefficient, logD

3.035

Water Solubility, LogSw

-4.54

Polar Surface Area

79.259

Acid Dissociation Constant (pKa)

6.35

Base Dissociation Constant (pKb)

2.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

G571-0226 in Drug Discovery

Included in Screening Libraries

Human Receptors Annotated Library (5376 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G571-0226 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G571-0226?
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What is the minimum amount of G571-0226 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G571-0226
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G571-0226
  • 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 G571-0226 available by request