D137-0607 Screening compound: N-(4-ethoxyphenyl)-3-(phenoxymethyl)-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide

D137-0607 Screening compound: N-(4-ethoxyphenyl)-3-(phenoxymethyl)-6-phenyl-5H,6H,7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
D137-0607 Screening compound: N-(4-ethoxyphenyl)-3-(phenoxymethyl)-6-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 D137-0607
N-(4-ethoxyphenyl)-3-(phenoxymethyl)-6-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

D137-0607

Molecular Formula

C26H25N5O3S (C26 H25 N5 O3 S)

Compound Name

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

IUPAC name

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

SMILES

CCOc(cc1)ccc1NC(C1Sc2nnc(COc3ccccc3)n2NC1c1ccccc1)=O

InChI

InChI=1S/C26H25N5O3S/c1-2-33-21-15-13-19(14-16-21)27-25(32)24-23(18-9-5-3-6-10-18)30-31-22(28-29-26(31)35-24)17-34-20-11-7-4-8-12-20/h3-16,23-24,30H,2,17H2,1H3,(H,27,32)

InChI Key

SVVFEYFYODAACN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08575507

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

487.58

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.400

Distribution Coefficient, logD

4.400

Water Solubility, LogSw

-4.15

Polar Surface Area

75.382

Acid Dissociation Constant (pKa)

11.35

Base Dissociation Constant (pKb)

2.60

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

19.20

D137-0607 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with D137-0607 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D137-0607?
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What is the minimum amount of D137-0607 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D137-0607
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D137-0607
  • 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 D137-0607 available by request