E866-0402 Screening compound: 4-{6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

E866-0402 Screening compound: 4-{6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide
E866-0402 Screening compound: 4-{6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E866-0402
4-{6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

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

E866-0402

Molecular Formula

C21H25N3O3S (C21 H25 N3 O3 S)

Compound Name

4-{6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

IUPAC name

4-{68-dimethyl-1H2H3H-pyrido[23-b][14]thiazin-1-yl}-N-[(2-methoxyphenyl)methyl]-4-oxobutanamide

SMILES

Cc(cc(C)nc1SCC2)c1N2C(CCC(NCc(cccc1)c1OC)=O)=O

InChI

InChI=1S/C21H25N3O3S/c1-14-12-15(2)23-21-20(14)24(10-11-28-21)19(26)9-8-18(25)22-13-16-6-4-5-7-17(16)27-3/h4-7,12H,8-11,13H2,1-3H3,(H,22,25)

InChI Key

YCDXFQPQFIURFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14924561

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.907

Distribution Coefficient, logD

2.906

Water Solubility, LogSw

-3.18

Polar Surface Area

58.710

Acid Dissociation Constant (pKa)

12.94

Base Dissociation Constant (pKb)

4.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with E866-0402 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E866-0402?
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What is the minimum amount of E866-0402 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E866-0402
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E866-0402
  • 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 E866-0402 available by request