F128-0078 Screening compound: 4-amino-3-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide

F128-0078 Screening compound: 4-amino-3-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
F128-0078 Screening compound: 4-amino-3-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F128-0078
4-amino-3-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide

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

F128-0078

Molecular Formula

C18H16ClN3OS2 (C18 H16 ClN3 OS2)

Compound Name

4-amino-3-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide

IUPAC name

4-amino-3-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-2-sulfanylidene-23-dihydro-13-thiazole-5-carboxamide

SMILES

Cc1ccc(CNC(C(SC2=S)=C(N)N2c(cc2)ccc2Cl)=O)cc1

InChI

InChI=1S/C18H16ClN3OS2/c1-11-2-4-12(5-3-11)10-21-17(23)15-16(20)22(18(24)25-15)14-8-6-13(19)7-9-14/h2-9H,10,20H2,1H3,(H,21,23)

InChI Key

LWAPNXGYZXUISY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09981223

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.93

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.950

Distribution Coefficient, logD

3.950

Water Solubility, LogSw

-4.44

Polar Surface Area

47.528

Acid Dissociation Constant (pKa)

14.63

Base Dissociation Constant (pKb)

-3.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

References: we are preparing a list of scientific research reports with F128-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F128-0078?
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What is the minimum amount of F128-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F128-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F128-0078
  • 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 F128-0078 available by request