7238-2061 Screening compound: 6-(4-methylphenyl)-3-phenyl-N,N-dipropyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

7238-2061 Screening compound: 6-(4-methylphenyl)-3-phenyl-N,N-dipropyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
7238-2061 Screening compound: 6-(4-methylphenyl)-3-phenyl-N,N-dipropyl-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 7238-2061
6-(4-methylphenyl)-3-phenyl-N,N-dipropyl-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

7238-2061

Molecular Formula

C24H29N5OS (C24 H29 N5 OS)

Compound Name

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

IUPAC name

6-(4-methylphenyl)-3-phenyl-NN-dipropyl-5H6H7H-[124]triazolo[34-b][134]thiadiazine-7-carboxamide

SMILES

CCCN(CCC)C(C1Sc2nnc(-c3ccccc3)n2NC1c1ccc(C)cc1)=O

InChI

InChI=1S/C24H29N5OS/c1-4-15-28(16-5-2)23(30)21-20(18-13-11-17(3)12-14-18)27-29-22(25-26-24(29)31-21)19-9-7-6-8-10-19/h6-14,20-21,27H,4-5,15-16H2,1-3H3

InChI Key

JVFMSYAGELZABS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08098688

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.59

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.082

Distribution Coefficient, logD

5.082

Water Solubility, LogSw

-4.87

Polar Surface Area

53.131

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

6.13

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

37.50

7238-2061 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with 7238-2061 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7238-2061?
Check Price and Availability of 7238-2061, 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 7238-2061 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7238-2061
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7238-2061
  • 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 7238-2061 available by request