7152-3173 Screening compound: 7-fluoro-1-[4-(methylsulfanyl)phenyl]-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

7152-3173 Screening compound: 7-fluoro-1-[4-(methylsulfanyl)phenyl]-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
7152-3173 Screening compound: 7-fluoro-1-[4-(methylsulfanyl)phenyl]-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound 7152-3173
7-fluoro-1-[4-(methylsulfanyl)phenyl]-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

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

7152-3173

Molecular Formula

C23H18FN3O3S2 (C23 H18 FN3 O3 S2)

Compound Name

7-fluoro-1-[4-(methylsulfanyl)phenyl]-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione

IUPAC name

7-fluoro-1-[4-(methylsulfanyl)phenyl]-2-(5-propyl-134-thiadiazol-2-yl)-1H2H3H9H-chromeno[23-c]pyrrole-39-dione

SMILES

CCCc1nnc(N(C(C2=C3Oc(ccc(F)c4)c4C2=O)c(cc2)ccc2SC)C3=O)s1

InChI

InChI=1S/C23H18FN3O3S2/c1-3-4-17-25-26-23(32-17)27-19(12-5-8-14(31-2)9-6-12)18-20(28)15-11-13(24)7-10-16(15)30-21(18)22(27)29/h5-11,19H,3-4H2,1-2H3/t19-/m1/s1

InChI Key

BQDKXUYGQREBFT-LJQANCHMSA-N

MDL Number (MFCD)

MFCD06645072

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.54

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.303

Distribution Coefficient, logD

5.303

Water Solubility, LogSw

-5.48

Polar Surface Area

59.936

Acid Dissociation Constant (pKa)

11.10

Base Dissociation Constant (pKb)

-8.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

21.70

7152-3173 in Drug Discovery

Included in Screening Libraries

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 7152-3173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7152-3173?
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What is the minimum amount of 7152-3173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7152-3173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7152-3173
  • 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 7152-3173 available by request