E135-0803 Screening compound: 5-(3,4-dimethoxyphenyl)-N~3~-(2-methoxyethyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

E135-0803 Screening compound: 5-(3,4-dimethoxyphenyl)-N~3~-(2-methoxyethyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
E135-0803 Screening compound: 5-(3,4-dimethoxyphenyl)-N~3~-(2-methoxyethyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E135-0803
5-(3,4-dimethoxyphenyl)-N~3~-(2-methoxyethyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-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

E135-0803

Molecular Formula

C16H21N3O6S (C16 H21 N3 O6 S)

Compound Name

5-(3,4-dimethoxyphenyl)-N~3~-(2-methoxyethyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

IUPAC name

5-(34-dimethoxyphenyl)-N-(2-methoxyethyl)-2-methyl-11-dioxo-2H-1lambda626-thiadiazine-3-carboxamide

SMILES

CN(C(C(NCCOC)=O)=CC(c(cc1)cc(OC)c1OC)=N1)S1(=O)=O

InChI

InChI=1S/C16H21N3O6S/c1-19-13(16(20)17-7-8-23-2)10-12(18-26(19,21)22)11-5-6-14(24-3)15(9-11)25-4/h5-6,9-10H,7-8H2,1-4H3,(H,17,20)

InChI Key

GMVNGBDGNPQQCL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14840956

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.43

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.626

Distribution Coefficient, logD

0.625

Water Solubility, LogSw

-2.38

Polar Surface Area

93.357

Acid Dissociation Constant (pKa)

10.06

Base Dissociation Constant (pKb)

-0.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

References: we are preparing a list of scientific research reports with E135-0803 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E135-0803?
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What is the minimum amount of E135-0803 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E135-0803
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E135-0803
  • 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 E135-0803 available by request