Y600-4502 Screening compound: 3-[(isobutylamino)sulfonyl]-2-thiophenecarboxylic acid

Y600-4502 Screening compound: 3-[(isobutylamino)sulfonyl]-2-thiophenecarboxylic acid
Y600-4502 Screening compound: 3-[(isobutylamino)sulfonyl]-2-thiophenecarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound Y600-4502
3-[(isobutylamino)sulfonyl]-2-thiophenecarboxylic acid

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

Y600-4502

Molecular Formula

C9H13NO4S2 (C9 H13 NO4 S2)

Compound Name

3-[(isobutylamino)sulfonyl]-2-thiophenecarboxylic acid

IUPAC name

3-[(2-methylpropyl)sulfamoyl]thiophene-2-carboxylic acid

SMILES

CC(C)CNS(c1c(C(O)=O)scc1)(=O)=O

InChI

InChI=1S/C9H13NO4S2/c1-6(2)5-10-16(13,14)7-3-4-15-8(7)9(11)12/h3-4,6,10H,5H2,1-2H3,(H,11,12)

InChI Key

ULWPHXSCILPQSS-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.34

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.449

Distribution Coefficient, logD

-3.520

Water Solubility, LogSw

-2.15

Polar Surface Area

71.695

Acid Dissociation Constant (pKa)

2.43

Base Dissociation Constant (pKb)

-3.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

44.44

References: we are preparing a list of scientific research reports with Y600-4502 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y600-4502?
Check Price and Availability of Y600-4502, 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 Y600-4502 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y600-4502
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y600-4502
  • 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 Y600-4502 available by request