E772-0404 Screening compound: 4-({6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}methyl)-N-(3-ethylphenyl)benzamide

E772-0404 Screening compound: 4-({6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}methyl)-N-(3-ethylphenyl)benzamide
E772-0404 Screening compound: 4-({6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}methyl)-N-(3-ethylphenyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E772-0404
4-({6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}methyl)-N-(3-ethylphenyl)benzamide

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

E772-0404

Molecular Formula

C25H25N3O2S (C25 H25 N3 O2 S)

Compound Name

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

IUPAC name

4-({68-dimethyl-2-oxo-1H2H3H-pyrido[23-b][14]thiazin-1-yl}methyl)-N-(3-ethylphenyl)benzamide

SMILES

CCc1cccc(NC(c2ccc(CN3c4c(C)cc(C)nc4SCC3=O)cc2)=O)c1

InChI

InChI=1S/C25H25N3O2S/c1-4-18-6-5-7-21(13-18)27-24(30)20-10-8-19(9-11-20)14-28-22(29)15-31-25-23(28)16(2)12-17(3)26-25/h5-13H,4,14-15H2,1-3H3,(H,27,30)

InChI Key

LRZCBSDULYRSIV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14917459

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.56

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.194

Distribution Coefficient, logD

5.193

Water Solubility, LogSw

-4.99

Polar Surface Area

50.294

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

4.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with E772-0404 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E772-0404?
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What is the minimum amount of E772-0404 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E772-0404
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E772-0404
  • 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 E772-0404 available by request