Screening compound: MFCD03133587

Screening compound: MFCD03133587
Screening compound: MFCD03133587 alternative view

Chemical Structure Depiction of ChemDiv screening compound
MFCD03133587

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

8012-7595

Molecular Formula

C25H22ClN9O4S (C25 H22 ClN9 O4 S)

Compound Name

5-[(2-{[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]-2-phenyl-2H-1,2,3-triazole-4-carboxamide

IUPAC name

5-[2-({7-[(2-chlorophenyl)methyl]-13-dimethyl-26-dioxo-2367-tetrahydro-1H-purin-8-yl}sulfanyl)acetamido]-2-phenyl-2H-123-triazole-4-carboxamide

SMILES

CN(c1c(C(N2C)=O)n(Cc(cccc3)c3Cl)c(SCC(Nc3nn(-c4ccccc4)nc3C(N)=O)=O)n1)C2=O

InChI

InChI=1S/C25H22ClN9O4S/c1-32-22-19(23(38)33(2)25(32)39)34(12-14-8-6-7-11-16(14)26)24(29-22)40-13-17(36)28-21-18(20(27)37)30-35(31-21)15-9-4-3-5-10-15/h3-11H,12-13H2,1-2H3,(H2,27,37)(H,28,31,36)

InChI Key

DBOGWXIYYBUWNS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03133587

MFCD03133587 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 MFCD03133587 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound MFCD03133587?
Check Price and Availability of MFCD03133587, 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 MFCD03133587 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for MFCD03133587
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for MFCD03133587
  • 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 MFCD03133587 available by request