E521-1261 Screening compound: 4-{3-oxo-2-phenyl-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-4-yl}-N-(2,4,6-trimethylphenyl)butanamide

E521-1261 Screening compound: 4-{3-oxo-2-phenyl-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-4-yl}-N-(2,4,6-trimethylphenyl)butanamide
E521-1261 Screening compound: 4-{3-oxo-2-phenyl-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-4-yl}-N-(2,4,6-trimethylphenyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E521-1261
4-{3-oxo-2-phenyl-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-4-yl}-N-(2,4,6-trimethylphenyl)butanamide

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

E521-1261

Molecular Formula

C26H27N3O3 (C26 H27 N3 O3)

Compound Name

4-{3-oxo-2-phenyl-2H,3H,4H-pyrido[3,2-b][1,4]oxazin-4-yl}-N-(2,4,6-trimethylphenyl)butanamide

IUPAC name

4-{3-oxo-2-phenyl-2H3H4H-pyrido[32-b][14]oxazin-4-yl}-N-(246-trimethylphenyl)butanamide

SMILES

Cc(cc1C)cc(C)c1NC(CCCN1c2ncccc2OC(c2ccccc2)C1=O)=O

InChI

InChI=1S/C26H27N3O3/c1-17-15-18(2)23(19(3)16-17)28-22(30)12-8-14-29-25-21(11-7-13-27-25)32-24(26(29)31)20-9-5-4-6-10-20/h4-7,9-11,13,15-16,24H,8,12,14H2,1-3H3,(H,28,30)/t24-/m0/s1

InChI Key

BHHKXFYKFXBXQD-DEOSSOPVSA-N

MDL Number (MFCD)

MFCD14894402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

429.52

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.565

Distribution Coefficient, logD

3.565

Water Solubility, LogSw

-3.55

Polar Surface Area

54.815

Acid Dissociation Constant (pKa)

11.92

Base Dissociation Constant (pKb)

0.30

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

26.90

References: we are preparing a list of scientific research reports with E521-1261 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E521-1261?
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What is the minimum amount of E521-1261 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E521-1261
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E521-1261
  • 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 E521-1261 available by request