T813-0085 Screening compound: 1-[(5-phenyl-1,2-oxazol-4-yl)methyl]-4-(pyridin-2-yl)piperazine

T813-0085 Screening compound: 1-[(5-phenyl-1,2-oxazol-4-yl)methyl]-4-(pyridin-2-yl)piperazine
T813-0085 Screening compound: 1-[(5-phenyl-1,2-oxazol-4-yl)methyl]-4-(pyridin-2-yl)piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound T813-0085
1-[(5-phenyl-1,2-oxazol-4-yl)methyl]-4-(pyridin-2-yl)piperazine

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

T813-0085

Molecular Formula

C19H20N4O (C19 H20 N4 O)

Compound Name

1-[(5-phenyl-1,2-oxazol-4-yl)methyl]-4-(pyridin-2-yl)piperazine

IUPAC name

1-[(5-phenyl-12-oxazol-4-yl)methyl]-4-(pyridin-2-yl)piperazine

SMILES

C(c1c(-c2ccccc2)onc1)N(CC1)CCN1c1ncccc1

InChI

InChI=1S/C19H20N4O/c1-2-6-16(7-3-1)19-17(14-21-24-19)15-22-10-12-23(13-11-22)18-8-4-5-9-20-18/h1-9,14H,10-13,15H2

InChI Key

QTXRORKVEQYLJP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27623691

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.044

Distribution Coefficient, logD

2.714

Water Solubility, LogSw

-2.81

Polar Surface Area

37.934

Acid Dissociation Constant (pKa)

24.27

Base Dissociation Constant (pKb)

7.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

T813-0085 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

SmartTM Library (51161 compounds)

Akt-Targeted Library (14764 compounds)

Antibacterial Compounds Library (13827 compounds)

Epigenetics Focused Set (26518 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with T813-0085 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T813-0085?
Check Price and Availability of T813-0085, 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 T813-0085 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T813-0085
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T813-0085
  • 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 T813-0085 available by request