E867-0949 Screening compound: 6,8-dimethyl-N-[4-(morpholine-4-carbonyl)phenyl]-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

E867-0949 Screening compound: 6,8-dimethyl-N-[4-(morpholine-4-carbonyl)phenyl]-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide
E867-0949 Screening compound: 6,8-dimethyl-N-[4-(morpholine-4-carbonyl)phenyl]-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E867-0949
6,8-dimethyl-N-[4-(morpholine-4-carbonyl)phenyl]-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

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

E867-0949

Molecular Formula

C21H24N4O3S (C21 H24 N4 O3 S)

Compound Name

6,8-dimethyl-N-[4-(morpholine-4-carbonyl)phenyl]-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

IUPAC name

68-dimethyl-N-[4-(morpholine-4-carbonyl)phenyl]-1H2H3H-pyrido[23-b][14]thiazine-1-carboxamide

SMILES

Cc(cc(C)nc1SCC2)c1N2C(Nc(cc1)ccc1C(N1CCOCC1)=O)=O

InChI

InChI=1S/C21H24N4O3S/c1-14-13-15(2)22-19-18(14)25(9-12-29-19)21(27)23-17-5-3-16(4-6-17)20(26)24-7-10-28-11-8-24/h3-6,13H,7-12H2,1-2H3,(H,23,27)

InChI Key

LHGMDPWTQDJSLN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14924835

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

412.51

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.405

Distribution Coefficient, logD

2.405

Water Solubility, LogSw

-2.84

Polar Surface Area

60.513

Acid Dissociation Constant (pKa)

11.29

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

E867-0949 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with E867-0949 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E867-0949?
Check Price and Availability of E867-0949, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of E867-0949 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E867-0949
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E867-0949
  • 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 E867-0949 available by request