6000-1608 Screening compound: 4-amino-N-benzyl-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide

6000-1608 Screening compound: 4-amino-N-benzyl-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide
6000-1608 Screening compound: 4-amino-N-benzyl-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 6000-1608
4-amino-N-benzyl-3-ethyl-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

6000-1608

Molecular Formula

C13H15N3OS2 (C13 H15 N3 OS2)

Compound Name

4-amino-N-benzyl-3-ethyl-2-sulfanylidene-2,3-dihydro-1,3-thiazole-5-carboxamide

IUPAC name

4-amino-N-benzyl-3-ethyl-2-sulfanylidene-23-dihydro-13-thiazole-5-carboxamide

SMILES

CCN(C(N)=C(C(NCc1ccccc1)=O)S1)C1=S

InChI

InChI=1S/C13H15N3OS2/c1-2-16-11(14)10(19-13(16)18)12(17)15-8-9-6-4-3-5-7-9/h3-7H,2,8,14H2,1H3,(H,15,17)

InChI Key

OBOKCFHKXAENJD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04441723

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

293.41

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

2.106

Distribution Coefficient, logD

2.106

Water Solubility, LogSw

-2.62

Polar Surface Area

48.136

Acid Dissociation Constant (pKa)

14.24

Base Dissociation Constant (pKb)

0.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

6000-1608 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 6000-1608 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6000-1608?
Check Price and Availability of 6000-1608, 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 6000-1608 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6000-1608
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6000-1608
  • 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 6000-1608 available by request