D050-0069 Screening compound: N-(1,2-benzoxazol-3-yl)pentanamide

D050-0069 Screening compound: N-(1,2-benzoxazol-3-yl)pentanamide
D050-0069 Screening compound: N-(1,2-benzoxazol-3-yl)pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D050-0069
N-(1,2-benzoxazol-3-yl)pentanamide

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

D050-0069

Molecular Formula

C12H14N2O2 (C12 H14 N2 O2)

Compound Name

N-(1,2-benzoxazol-3-yl)pentanamide

IUPAC name

N-(12-benzoxazol-3-yl)pentanamide

SMILES

CCCCC(Nc1noc2c1cccc2)=O

InChI

InChI=1S/C12H14N2O2/c1-2-3-8-11(15)13-12-9-6-4-5-7-10(9)16-14-12/h4-7H,2-3,8H2,1H3,(H,13,14,15)

InChI Key

WMNKJXHDIWPOJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08362445

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

218.26

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.838

Distribution Coefficient, logD

2.835

Water Solubility, LogSw

-3.13

Polar Surface Area

45.456

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

-0.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

D050-0069 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with D050-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D050-0069?
Check Price and Availability of D050-0069, 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 D050-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D050-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D050-0069
  • 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 D050-0069 available by request