K904-0418 Screening compound: 2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(2,2-diethoxyethyl)acetamide

K904-0418 Screening compound: 2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(2,2-diethoxyethyl)acetamide
K904-0418 Screening compound: 2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(2,2-diethoxyethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K904-0418
2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(2,2-diethoxyethyl)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

K904-0418

Molecular Formula

C15H19ClN2O5 (C15 H19 ClN2 O5)

Compound Name

2-(6-chloro-2-oxo-2,3-dihydro-1,3-benzoxazol-3-yl)-N-(2,2-diethoxyethyl)acetamide

IUPAC name

2-(6-chloro-2-oxo-23-dihydro-13-benzoxazol-3-yl)-N-(22-diethoxyethyl)acetamide

SMILES

CCOC(CNC(CN(c(ccc(Cl)c1)c1O1)C1=O)=O)OCC

InChI

InChI=1S/C15H19ClN2O5/c1-3-21-14(22-4-2)8-17-13(19)9-18-11-6-5-10(16)7-12(11)23-15(18)20/h5-7,14H,3-4,8-9H2,1-2H3,(H,17,19)

InChI Key

UKIKOZXFQQQAFH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03020207

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.78

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.809

Distribution Coefficient, logD

1.809

Water Solubility, LogSw

-2.87

Polar Surface Area

62.464

Acid Dissociation Constant (pKa)

14.05

Base Dissociation Constant (pKb)

-0.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

References: we are preparing a list of scientific research reports with K904-0418 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K904-0418?
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What is the minimum amount of K904-0418 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K904-0418
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K904-0418
  • 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 K904-0418 available by request