Screening compound: MFCD04462040

Screening compound: MFCD04462040
Screening compound: MFCD04462040 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD04462040

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

C263-0145

Molecular Formula

C22H22ClN3O6S (C22 H22 ClN3 O6 S)

Compound Name

1-tert-butyl-3-methyl-4-(4-methylbenzenesulfonyl)-1H-pyrazol-5-yl 4-chloro-3-nitrobenzoate

IUPAC name

1-tert-butyl-3-methyl-4-(4-methylbenzenesulfonyl)-1H-pyrazol-5-yl 4-chloro-3-nitrobenzoate

SMILES

CC(C)(C)n1nc(C)c(S(c2ccc(C)cc2)(=O)=O)c1OC(c(cc1)cc([N+]([O-])=O)c1Cl)=O

InChI

InChI=1S/C22H22ClN3O6S/c1-13-6-9-16(10-7-13)33(30,31)19-14(2)24-25(22(3,4)5)20(19)32-21(27)15-8-11-17(23)18(12-15)26(28)29/h6-12H,1-5H3

InChI Key

VDVDFXOSYZTAQB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04462040

MFCD04462040 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with MFCD04462040 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD04462040?
Check Price and Availability of MFCD04462040, 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 MFCD04462040 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD04462040
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD04462040
  • 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 MFCD04462040 available by request