C527-1649 Screening compound: 2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-(1-phenylethyl)acetamide

C527-1649 Screening compound: 2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-(1-phenylethyl)acetamide
C527-1649 Screening compound: 2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-(1-phenylethyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C527-1649
2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-(1-phenylethyl)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

C527-1649

Molecular Formula

C23H26N2O5S (C23 H26 N2 O5 S)

Compound Name

2-{[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-N-(1-phenylethyl)acetamide

IUPAC name

2-{[2-(34-dimethoxyphenyl)-5-methyl-13-oxazol-4-yl]methanesulfinyl}-N-(1-phenylethyl)acetamide

SMILES

CC(c1ccccc1)NC(CS(Cc1c(C)oc(-c(cc2)cc(OC)c2OC)n1)=O)=O

InChI

InChI=1S/C23H28N2O5S/c1-15(17-8-6-5-7-9-17)24-22(26)14-31(27)13-19-16(2)30-23(25-19)18-10-11-20(28-3)21(12-18)29-4/h5-12,15H,13-14,31H2,1-4H3,(H,24,26)

InChI Key

UCWQVVNYMNZPMV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14766783

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.54

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.498

Distribution Coefficient, logD

2.498

Water Solubility, LogSw

-3.05

Polar Surface Area

72.028

Acid Dissociation Constant (pKa)

12.76

Base Dissociation Constant (pKb)

0.13

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

References: we are preparing a list of scientific research reports with C527-1649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C527-1649?
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What is the minimum amount of C527-1649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C527-1649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C527-1649
  • 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 C527-1649 available by request