Y600-0878 Screening compound: N-[4-(aminosulfonyl)phenyl]-2-(3,4,5-triethoxybenzoyl)-1-hydrazinecarbothioamide

Y600-0878 Screening compound: N-[4-(aminosulfonyl)phenyl]-2-(3,4,5-triethoxybenzoyl)-1-hydrazinecarbothioamide
Y600-0878 Screening compound: N-[4-(aminosulfonyl)phenyl]-2-(3,4,5-triethoxybenzoyl)-1-hydrazinecarbothioamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-0878
N-[4-(aminosulfonyl)phenyl]-2-(3,4,5-triethoxybenzoyl)-1-hydrazinecarbothioamide

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

Y600-0878

Molecular Formula

C20H26N4O6S2 (C20 H26 N4 O6 S2)

Compound Name

N-[4-(aminosulfonyl)phenyl]-2-(3,4,5-triethoxybenzoyl)-1-hydrazinecarbothioamide

IUPAC name

345-triethoxy-N-{[(4-sulfamoylphenyl)carbamothioyl]amino}benzamide

SMILES

CCOc1cc(C(NNC(Nc(cc2)ccc2S(N)(=O)=O)=S)=O)cc(OCC)c1OCC

InChI

InChI=1S/C20H26N4O6S2/c1-4-28-16-11-13(12-17(29-5-2)18(16)30-6-3)19(25)23-24-20(31)22-14-7-9-15(10-8-14)32(21,26)27/h7-12H,4-6H2,1-3H3,(H,23,25)(H2,21,26,27)(H2,22,24,31)

InChI Key

ZXURUEREJSGYNS-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

482.58

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

5.00

Rotatable Bond Count

13.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.848

Distribution Coefficient, logD

1.843

Water Solubility, LogSw

-2.54

Polar Surface Area

119.487

Acid Dissociation Constant (pKa)

9.42

Base Dissociation Constant (pKb)

3.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

Y600-0878 in Drug Discovery

Included in Screening Libraries

Carbonic Anhydrase II Library (4939 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with Y600-0878 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-0878?
Check Price and Availability of Y600-0878, 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 Y600-0878 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-0878
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-0878
  • 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 Y600-0878 available by request