8451-02255 Screening compound: N-{4-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}-1,3-benzoxazol-2-amine

8451-02255 Screening compound: N-{4-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}-1,3-benzoxazol-2-amine
8451-02255 Screening compound: N-{4-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}-1,3-benzoxazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8451-02255
N-{4-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}-1,3-benzoxazol-2-amine

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

8451-02255

Molecular Formula

C15H14N4O (C15 H14 N4 O)

Compound Name

N-{4-methyl-5H,6H,7H-cyclopenta[d]pyrimidin-2-yl}-1,3-benzoxazol-2-amine

IUPAC name

N-{4-methyl-5H6H7H-cyclopenta[d]pyrimidin-2-yl}-13-benzoxazol-2-amine

SMILES

Cc1c(CCC2)c2nc(Nc2nc(cccc3)c3o2)n1

InChI

InChI=1S/C15H14N4O/c1-9-10-5-4-7-11(10)17-14(16-9)19-15-18-12-6-2-3-8-13(12)20-15/h2-3,6,8H,4-5,7H2,1H3,(H,16,17,18,19)

InChI Key

CUIMFHYVLPETHK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03146984

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.604

Distribution Coefficient, logD

3.573

Water Solubility, LogSw

-3.72

Polar Surface Area

49.615

Acid Dissociation Constant (pKa)

14.68

Base Dissociation Constant (pKb)

6.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.70

8451-02255 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Annotated Library (21441 compounds)

Fragments Library (11262 compounds)

Human Receptors Annotated Library (5376 compounds)

Human Transcription Factors Annotated Library (5098 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8451-02255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8451-02255?
Check Price and Availability of 8451-02255, 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 8451-02255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8451-02255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8451-02255
  • 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 8451-02255 available by request