D365-0228 Screening compound: 2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)-N-phenylpropanamide

D365-0228 Screening compound: 2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)-N-phenylpropanamide
D365-0228 Screening compound: 2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)-N-phenylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D365-0228
2-({4-oxo-3H,4H,5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}sulfanyl)-N-phenylpropanamide

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

D365-0228

Molecular Formula

C16H17N3O2S (C16 H17 N3 O2 S)

Compound Name

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

IUPAC name

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

SMILES

CC(C(Nc1ccccc1)=O)SC(N1)=NC(CCC2)=C2C1=O

InChI

InChI=1S/C16H17N3O2S/c1-10(14(20)17-11-6-3-2-4-7-11)22-16-18-13-9-5-8-12(13)15(21)19-16/h2-4,6-7,10H,5,8-9H2,1H3,(H,17,20)(H,18,19,21)/t10-/m0/s1

InChI Key

MAQNGVHHKQVIHQ-JTQLQIEISA-N

MDL Number (MFCD)

MFCD10479982

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

315.4

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

2.009

Distribution Coefficient, logD

1.919

Water Solubility, LogSw

-2.51

Polar Surface Area

58.201

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

-0.39

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.30

D365-0228 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with D365-0228 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D365-0228?
Check Price and Availability of D365-0228, 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 D365-0228 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D365-0228
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D365-0228
  • 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 D365-0228 available by request