E135-0154 Screening compound: N~3~-cyclohexyl-N~3~,2-dimethyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

E135-0154 Screening compound: N~3~-cyclohexyl-N~3~,2-dimethyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
E135-0154 Screening compound: N~3~-cyclohexyl-N~3~,2-dimethyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E135-0154
N~3~-cyclohexyl-N~3~,2-dimethyl-5-(4-methylphenyl)-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

E135-0154

Molecular Formula

C19H25N3O3S (C19 H25 N3 O3 S)

Compound Name

N~3~-cyclohexyl-N~3~,2-dimethyl-5-(4-methylphenyl)-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide

IUPAC name

N-cyclohexyl-N2-dimethyl-5-(4-methylphenyl)-11-dioxo-2H-1lambda626-thiadiazine-3-carboxamide

SMILES

Cc(cc1)ccc1C(C=C(C(N(C)C1CCCCC1)=O)N1C)=NS1(=O)=O

InChI

InChI=1S/C19H25N3O3S/c1-14-9-11-15(12-10-14)17-13-18(22(3)26(24,25)20-17)19(23)21(2)16-7-5-4-6-8-16/h9-13,16H,4-8H2,1-3H3

InChI Key

YVJLUMXARODNNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09783408

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.49

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.293

Distribution Coefficient, logD

3.293

Water Solubility, LogSw

-3.48

Polar Surface Area

60.429

Acid Dissociation Constant (pKa)

27.32

Base Dissociation Constant (pKb)

-1.37

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.40

E135-0154 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

Human Proteases Annotated Library (2868 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with E135-0154 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E135-0154?
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What is the minimum amount of E135-0154 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E135-0154
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E135-0154
  • 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 E135-0154 available by request