C082-0701 Screening compound: N-[2-(2-CHLOROPHENYL)ETHYL]-2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)ACETAMIDE

C082-0701 Screening compound: N-[2-(2-CHLOROPHENYL)ETHYL]-2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)ACETAMIDE
C082-0701 Screening compound: N-[2-(2-CHLOROPHENYL)ETHYL]-2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)ACETAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound C082-0701
N-[2-(2-CHLOROPHENYL)ETHYL]-2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)ACETAMIDE

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

C082-0701

Molecular Formula

C17H15ClN2O3 (C17 H15 ClN2 O3)

Compound Name

N-[2-(2-CHLOROPHENYL)ETHYL]-2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-3-YL)ACETAMIDE

IUPAC name

n/a

SMILES

O=C(CN(c(cccc1)c1O1)C1=O)NCCc(cccc1)c1Cl

InChI

InChI=1S/C17H15ClN2O3/c18-13-6-2-1-5-12(13)9-10-19-16(21)11-20-14-7-3-4-8-15(14)23-17(20)22/h1-8H,9-11H2,(H,19,21)

InChI Key

KPQUVDHIXHPWJX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14717921

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

330.77

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.794

Distribution Coefficient, logD

2.794

Water Solubility, LogSw

-3.53

Polar Surface Area

47.380

Acid Dissociation Constant (pKa)

14.64

Base Dissociation Constant (pKb)

0.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.00

C082-0701 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with C082-0701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C082-0701?
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What is the minimum amount of C082-0701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C082-0701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C082-0701
  • 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 C082-0701 available by request