D365-0178 Screening compound: N-(4-fluorophenyl)-2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)acetamide

D365-0178 Screening compound: N-(4-fluorophenyl)-2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)acetamide
D365-0178 Screening compound: N-(4-fluorophenyl)-2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D365-0178
N-(4-fluorophenyl)-2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)acetamide

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

D365-0178

Molecular Formula

C15H14FN3O2S (C15 H14 FN3 O2 S)

Compound Name

N-(4-fluorophenyl)-2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)acetamide

IUPAC name

N-(4-fluorophenyl)-2-({4-oxo-3H4H5H6H7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)acetamide

SMILES

O=C(CSC(N1)=NC(CCC2)=C2C1=O)Nc(cc1)ccc1F

InChI

InChI=1S/C15H14FN3O2S/c16-9-4-6-10(7-5-9)17-13(20)8-22-15-18-12-3-1-2-11(12)14(21)19-15/h4-7H,1-3,8H2,(H,17,20)(H,18,19,21)

InChI Key

IGHOPQMEVJAMCQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09057205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

319.36

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.677

Distribution Coefficient, logD

1.461

Water Solubility, LogSw

-2.41

Polar Surface Area

57.987

Acid Dissociation Constant (pKa)

7.59

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

D365-0178 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

KRAS-Targeted Library (16000 compounds)

New Agro Library (44492 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with D365-0178 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D365-0178?
Check Price and Availability of D365-0178, 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 D365-0178 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D365-0178
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D365-0178
  • 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 D365-0178 available by request