7152-3156 Screening compound: methyl 4-[7-fluoro-3,9-dioxo-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrol-1-yl]benzoate

7152-3156 Screening compound: methyl 4-[7-fluoro-3,9-dioxo-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrol-1-yl]benzoate
7152-3156 Screening compound: methyl 4-[7-fluoro-3,9-dioxo-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrol-1-yl]benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7152-3156
methyl 4-[7-fluoro-3,9-dioxo-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrol-1-yl]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

7152-3156

Molecular Formula

C24H18FN3O5S (C24 H18 FN3 O5 S)

Compound Name

methyl 4-[7-fluoro-3,9-dioxo-2-(5-propyl-1,3,4-thiadiazol-2-yl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrol-1-yl]benzoate

IUPAC name

methyl 4-[7-fluoro-39-dioxo-2-(5-propyl-134-thiadiazol-2-yl)-1H2H3H9H-chromeno[23-c]pyrrol-1-yl]benzoate

SMILES

CCCc1nnc(N(C(C2=C3Oc(ccc(F)c4)c4C2=O)c(cc2)ccc2C(OC)=O)C3=O)s1

InChI

InChI=1S/C24H18FN3O5S/c1-3-4-17-26-27-24(34-17)28-19(12-5-7-13(8-6-12)23(31)32-2)18-20(29)15-11-14(25)9-10-16(15)33-21(18)22(28)30/h5-11,19H,3-4H2,1-2H3/t19-/m1/s1

InChI Key

UYHIGLFDZOSEGN-LJQANCHMSA-N

MDL Number (MFCD)

MFCD06645891

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.49

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.675

Distribution Coefficient, logD

4.675

Water Solubility, LogSw

-4.65

Polar Surface Area

81.110

Acid Dissociation Constant (pKa)

11.10

Base Dissociation Constant (pKb)

-8.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.80

7152-3156 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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 7152-3156 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7152-3156?
Check Price and Availability of 7152-3156, 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 7152-3156 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7152-3156
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7152-3156
  • 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 7152-3156 available by request