Y200-5812 Screening compound: methyl 3-(3,5-dimethyl-1-phenyl-1H-pyrazole-4-sulfonamido)benzoate

Y200-5812 Screening compound: methyl 3-(3,5-dimethyl-1-phenyl-1H-pyrazole-4-sulfonamido)benzoate
Y200-5812 Screening compound: methyl 3-(3,5-dimethyl-1-phenyl-1H-pyrazole-4-sulfonamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound Y200-5812
methyl 3-(3,5-dimethyl-1-phenyl-1H-pyrazole-4-sulfonamido)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

Y200-5812

Molecular Formula

C19H19N3O4S (C19 H19 N3 O4 S)

Compound Name

methyl 3-(3,5-dimethyl-1-phenyl-1H-pyrazole-4-sulfonamido)benzoate

IUPAC name

methyl 3-(35-dimethyl-1-phenyl-1H-pyrazole-4-sulfonamido)benzoate

SMILES

Cc(n(-c1ccccc1)nc1C)c1S(Nc1cc(C(OC)=O)ccc1)(=O)=O

InChI

InChI=1S/C19H19N3O4S/c1-13-18(14(2)22(20-13)17-10-5-4-6-11-17)27(24,25)21-16-9-7-8-15(12-16)19(23)26-3/h4-12,21H,1-3H3

InChI Key

BRZNANQJIKETKD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05116688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.195

Distribution Coefficient, logD

3.120

Water Solubility, LogSw

-3.59

Polar Surface Area

76.480

Acid Dissociation Constant (pKa)

8.12

Base Dissociation Constant (pKb)

-2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.80

Y200-5812 in Drug Discovery

Included in Screening Libraries

SH2 Library (10483 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Endocrine
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with Y200-5812 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y200-5812?
Check Price and Availability of Y200-5812, 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 Y200-5812 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y200-5812
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y200-5812
  • 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 Y200-5812 available by request