7238-1799 Screening compound: N-(2,4-dimethylphenyl)-6-(4-methoxyphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

7238-1799 Screening compound: N-(2,4-dimethylphenyl)-6-(4-methoxyphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
7238-1799 Screening compound: N-(2,4-dimethylphenyl)-6-(4-methoxyphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 7238-1799
N-(2,4-dimethylphenyl)-6-(4-methoxyphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-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

7238-1799

Molecular Formula

C26H25N5O2S (C26 H25 N5 O2 S)

Compound Name

N-(2,4-dimethylphenyl)-6-(4-methoxyphenyl)-3-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

IUPAC name

N-(24-dimethylphenyl)-6-(4-methoxyphenyl)-3-phenyl-5H6H7H-[124]triazolo[34-b][134]thiadiazine-7-carboxamide

SMILES

Cc(cc1)cc(C)c1NC(C1Sc2nnc(-c3ccccc3)n2NC1c(cc1)ccc1OC)=O

InChI

InChI=1S/C26H25N5O2S/c1-16-9-14-21(17(2)15-16)27-25(32)23-22(18-10-12-20(33-3)13-11-18)30-31-24(28-29-26(31)34-23)19-7-5-4-6-8-19/h4-15,22-23,30H,1-3H3,(H,27,32)

InChI Key

DHLKEXXMWYSHPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08098575

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

471.58

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.296

Distribution Coefficient, logD

5.296

Water Solubility, LogSw

-5.34

Polar Surface Area

66.629

Acid Dissociation Constant (pKa)

11.31

Base Dissociation Constant (pKb)

2.57

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

19.20

7238-1799 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 7238-1799 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7238-1799?
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What is the minimum amount of 7238-1799 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7238-1799
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7238-1799
  • 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 7238-1799 available by request