E867-0582 Screening compound: N-{3-[(2,3-dimethylphenyl)carbamoyl]phenyl}-6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

E867-0582 Screening compound: N-{3-[(2,3-dimethylphenyl)carbamoyl]phenyl}-6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide
E867-0582 Screening compound: N-{3-[(2,3-dimethylphenyl)carbamoyl]phenyl}-6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E867-0582
N-{3-[(2,3-dimethylphenyl)carbamoyl]phenyl}-6,8-dimethyl-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

E867-0582

Molecular Formula

C25H26N4O2S (C25 H26 N4 O2 S)

Compound Name

N-{3-[(2,3-dimethylphenyl)carbamoyl]phenyl}-6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

IUPAC name

N-{3-[(23-dimethylphenyl)carbamoyl]phenyl}-68-dimethyl-1H2H3H-pyrido[23-b][14]thiazine-1-carboxamide

SMILES

Cc1cccc(NC(c2cccc(NC(N3c4c(C)cc(C)nc4SCC3)=O)c2)=O)c1C

InChI

InChI=1S/C25H26N4O2S/c1-15-7-5-10-21(18(15)4)28-23(30)19-8-6-9-20(14-19)27-25(31)29-11-12-32-24-22(29)16(2)13-17(3)26-24/h5-10,13-14H,11-12H2,1-4H3,(H,27,31)(H,28,30)

InChI Key

CLFSYFVGYOOJOM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27603198

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.57

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.612

Distribution Coefficient, logD

5.612

Water Solubility, LogSw

-5.36

Polar Surface Area

58.350

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

24.00

References: we are preparing a list of scientific research reports with E867-0582 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E867-0582?
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What is the minimum amount of E867-0582 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E867-0582
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E867-0582
  • 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 E867-0582 available by request