E867-0566 Screening compound: N-{3-[(butan-2-yl)carbamoyl]phenyl}-6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide

E867-0566 Screening compound: N-{3-[(butan-2-yl)carbamoyl]phenyl}-6,8-dimethyl-1H,2H,3H-pyrido[2,3-b][1,4]thiazine-1-carboxamide
E867-0566 Screening compound: N-{3-[(butan-2-yl)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 E867-0566
N-{3-[(butan-2-yl)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

E867-0566

Molecular Formula

C21H26N4O2S (C21 H26 N4 O2 S)

Compound Name

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

IUPAC name

N-{3-[(butan-2-yl)carbamoyl]phenyl}-68-dimethyl-1H2H3H-pyrido[23-b][14]thiazine-1-carboxamide

SMILES

CCC(C)NC(c1cccc(NC(N2c3c(C)cc(C)nc3SCC2)=O)c1)=O

InChI

InChI=1S/C21H26N4O2S/c1-5-14(3)22-19(26)16-7-6-8-17(12-16)24-21(27)25-9-10-28-20-18(25)13(2)11-15(4)23-20/h6-8,11-12,14H,5,9-10H2,1-4H3,(H,22,26)(H,24,27)/t14-/m0/s1

InChI Key

UXTPLBYILHXSIH-AWEZNQCLSA-N

MDL Number (MFCD)

MFCD27603186

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.53

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.729

Distribution Coefficient, logD

3.729

Water Solubility, LogSw

-3.91

Polar Surface Area

60.082

Acid Dissociation Constant (pKa)

13.11

Base Dissociation Constant (pKb)

3.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

38.10

References: we are preparing a list of scientific research reports with E867-0566 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E867-0566?
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What is the minimum amount of E867-0566 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E867-0566
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E867-0566
  • 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 E867-0566 available by request