2152-0278 Screening compound: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-methoxybenzamide

2152-0278 Screening compound: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-methoxybenzamide
2152-0278 Screening compound: N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2152-0278
N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-methoxybenzamide

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

2152-0278

Molecular Formula

C21H14ClFN2O3 (C21 H14 ClFN2 O3)

Compound Name

N-[2-(2-chloro-4-fluorophenyl)-1,3-benzoxazol-5-yl]-3-methoxybenzamide

IUPAC name

N-[2-(2-chloro-4-fluorophenyl)-13-benzoxazol-5-yl]-3-methoxybenzamide

SMILES

COc1cccc(C(Nc(cc2)cc3c2oc(-c(ccc(F)c2)c2Cl)n3)=O)c1

InChI

InChI=1S/C21H14ClFN2O3/c1-27-15-4-2-3-12(9-15)20(26)24-14-6-8-19-18(11-14)25-21(28-19)16-7-5-13(23)10-17(16)22/h2-11H,1H3,(H,24,26)

InChI Key

VWUOVRUAXRLJJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01535036

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

396.8

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.227

Distribution Coefficient, logD

5.227

Water Solubility, LogSw

-5.80

Polar Surface Area

47.684

Acid Dissociation Constant (pKa)

10.56

Base Dissociation Constant (pKb)

-2.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.80

2152-0278 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 2152-0278 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2152-0278?
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What is the minimum amount of 2152-0278 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2152-0278
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2152-0278
  • 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 2152-0278 available by request