C862-2043 Screening compound: 4-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-{[4-(propan-2-yloxy)phenyl]methyl}butanamide

C862-2043 Screening compound: 4-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-{[4-(propan-2-yloxy)phenyl]methyl}butanamide
C862-2043 Screening compound: 4-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-{[4-(propan-2-yloxy)phenyl]methyl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C862-2043
4-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-{[4-(propan-2-yloxy)phenyl]methyl}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

C862-2043

Molecular Formula

C23H29N3O3S (C23 H29 N3 O3 S)

Compound Name

4-{6,8-dimethyl-2-oxo-1H,2H,3H-pyrido[2,3-b][1,4]thiazin-1-yl}-N-{[4-(propan-2-yloxy)phenyl]methyl}butanamide

IUPAC name

4-{68-dimethyl-2-oxo-1H2H3H-pyrido[23-b][14]thiazin-1-yl}-N-{[4-(propan-2-yloxy)phenyl]methyl}butanamide

SMILES

CC(C)Oc1ccc(CNC(CCCN2c3c(C)cc(C)nc3SCC2=O)=O)cc1

InChI

InChI=1S/C23H29N3O3S/c1-15(2)29-19-9-7-18(8-10-19)13-24-20(27)6-5-11-26-21(28)14-30-23-22(26)16(3)12-17(4)25-23/h7-10,12,15H,5-6,11,13-14H2,1-4H3,(H,24,27)

InChI Key

XIWIMRUPHOOGDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14801998

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

427.57

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.181

Distribution Coefficient, logD

3.161

Water Solubility, LogSw

-3.27

Polar Surface Area

58.455

Acid Dissociation Constant (pKa)

14.02

Base Dissociation Constant (pKb)

6.08

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

C862-2043 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with C862-2043 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C862-2043?
Check Price and Availability of C862-2043, 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 C862-2043 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C862-2043
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C862-2043
  • 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 C862-2043 available by request