E135-0281 Screening compound: 1-{[5-(4-methoxyphenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazin-3-yl]carbonyl}-4-piperidinecarboxamide

E135-0281 Screening compound: 1-{[5-(4-methoxyphenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazin-3-yl]carbonyl}-4-piperidinecarboxamide
E135-0281 Screening compound: 1-{[5-(4-methoxyphenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazin-3-yl]carbonyl}-4-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E135-0281
1-{[5-(4-methoxyphenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazin-3-yl]carbonyl}-4-piperidinecarboxamide

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

E135-0281

Molecular Formula

C18H22N4O5S (C18 H22 N4 O5 S)

Compound Name

1-{[5-(4-methoxyphenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazin-3-yl]carbonyl}-4-piperidinecarboxamide

IUPAC name

1-[5-(4-methoxyphenyl)-2-methyl-11-dioxo-2H-1lambda626-thiadiazine-3-carbonyl]piperidine-4-carboxamide

SMILES

CN(C(C(N(CC1)CCC1C(N)=O)=O)=CC(c(cc1)ccc1OC)=N1)S1(=O)=O

InChI

InChI=1S/C18H22N4O5S/c1-21-16(18(24)22-9-7-13(8-10-22)17(19)23)11-15(20-28(21,25)26)12-3-5-14(27-2)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H2,19,23)

InChI Key

HPDVQRPYVRGWPH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09783488

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.46

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.502

Distribution Coefficient, logD

0.502

Water Solubility, LogSw

-2.03

Polar Surface Area

103.478

Acid Dissociation Constant (pKa)

14.92

Base Dissociation Constant (pKb)

4.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

E135-0281 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with E135-0281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E135-0281?
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What is the minimum amount of E135-0281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E135-0281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E135-0281
  • 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 E135-0281 available by request