K286-0103 Screening compound: ethyl 4-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazol-3-yl}benzoate

K286-0103 Screening compound: ethyl 4-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazol-3-yl}benzoate
K286-0103 Screening compound: ethyl 4-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazol-3-yl}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound K286-0103
ethyl 4-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazol-3-yl}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

K286-0103

Molecular Formula

C21H21N3O4S2 (C21 H21 N3 O4 S2)

Compound Name

ethyl 4-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazol-3-yl}benzoate

IUPAC name

ethyl 4-{4-amino-5-[(4-ethoxyphenyl)carbamoyl]-2-sulfanylidene-23-dihydro-13-thiazol-3-yl}benzoate

SMILES

CCOC(c(cc1)ccc1N(C(N)=C(C(Nc(cc1)ccc1OCC)=O)S1)C1=S)=O

InChI

InChI=1S/C21H21N3O4S2/c1-3-27-16-11-7-14(8-12-16)23-19(25)17-18(22)24(21(29)30-17)15-9-5-13(6-10-15)20(26)28-4-2/h5-12H,3-4,22H2,1-2H3,(H,23,25)

InChI Key

LJHCNVWJROXBOY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15090018

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

443.55

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.151

Distribution Coefficient, logD

4.151

Water Solubility, LogSw

-4.23

Polar Surface Area

74.083

Acid Dissociation Constant (pKa)

13.82

Base Dissociation Constant (pKb)

2.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

References: we are preparing a list of scientific research reports with K286-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K286-0103?
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What is the minimum amount of K286-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K286-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K286-0103
  • 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 K286-0103 available by request