E135-0318 Screening compound: 5-(3-methoxyphenyl)-2-methyl-1,1-dioxo-N~3~-(3-pyridylmethyl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

E135-0318 Screening compound: 5-(3-methoxyphenyl)-2-methyl-1,1-dioxo-N~3~-(3-pyridylmethyl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
E135-0318 Screening compound: 5-(3-methoxyphenyl)-2-methyl-1,1-dioxo-N~3~-(3-pyridylmethyl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E135-0318
5-(3-methoxyphenyl)-2-methyl-1,1-dioxo-N~3~-(3-pyridylmethyl)-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

E135-0318

Molecular Formula

C18H18N4O4S (C18 H18 N4 O4 S)

Compound Name

5-(3-methoxyphenyl)-2-methyl-1,1-dioxo-N~3~-(3-pyridylmethyl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

IUPAC name

5-(3-methoxyphenyl)-2-methyl-11-dioxo-N-[(pyridin-3-yl)methyl]-2H-1lambda626-thiadiazine-3-carboxamide

SMILES

CN(C(C(NCc1cnccc1)=O)=CC(c1cc(OC)ccc1)=N1)S1(=O)=O

InChI

InChI=1S/C18H18N4O4S/c1-22-17(18(23)20-12-13-5-4-8-19-11-13)10-16(21-27(22,24)25)14-6-3-7-15(9-14)26-2/h3-11H,12H2,1-2H3,(H,20,23)

InChI Key

DKSNQPHXMCDQHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14840873

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

386.43

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.344

Distribution Coefficient, logD

1.339

Water Solubility, LogSw

-1.85

Polar Surface Area

86.702

Acid Dissociation Constant (pKa)

9.40

Base Dissociation Constant (pKb)

3.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

References: we are preparing a list of scientific research reports with E135-0318 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E135-0318?
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What is the minimum amount of E135-0318 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E135-0318
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E135-0318
  • 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 E135-0318 available by request