Screening compound: InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2

Screening compound: InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2
Screening compound: InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2 alternative view

Chemical Structure Depiction of ChemDiv screening compound
InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2

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

M786-4198

Molecular Formula

C20H20ClN3O4S (C20 H20 ClN3 O4 S)

Compound Name

7-chloro-3-(morpholinocarbonyl)-1-phenethyl-4lambda~6~,1,2-benzothiadiazine-4,4(1H)-dione

IUPAC name

7-chloro-3-(morpholine-4-carbonyl)-1-(2-phenylethyl)-1H-4lambda612-benzothiadiazine-44-dione

SMILES

O=C(C1=NN(CCc2ccccc2)c(cc(cc2)Cl)c2S1(=O)=O)N1CCOCC1

InChI

InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2

InChI Key

SGUKCTXOZPVFBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27554239

InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2 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 InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2 chemical compound. It will be published here after verification.

Frequently Asked Questions

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What is the minimum amount of InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2
  • 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 InChI=1S/C20H20ClN3O4S/c21-16-6-7-18-17(14-16)24(9-8-15-4-2-1-3-5-15)22-19(29(18,26)27)20(25)23-10-12-28-13-11-23/h1-7,14H,8-13H2 available by request