Y300-0288 Screening compound: 4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-isobutylbenzamide

Y300-0288 Screening compound: 4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-isobutylbenzamide
Y300-0288 Screening compound: 4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-isobutylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y300-0288
4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-isobutylbenzamide

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

Y300-0288

Molecular Formula

C15H22N2O3S (C15 H22 N2 O3 S)

Compound Name

4-(1,1-dioxo-1lambda~6~,2-thiazinan-2-yl)-N~1~-isobutylbenzamide

IUPAC name

4-(11-dioxo-1lambda62-thiazinan-2-yl)-N-(2-methylpropyl)benzamide

SMILES

CC(C)CNC(c(cc1)ccc1N(CCCC1)S1(=O)=O)=O

InChI

InChI=1S/C15H22N2O3S/c1-12(2)11-16-15(18)13-5-7-14(8-6-13)17-9-3-4-10-21(17,19)20/h5-8,12H,3-4,9-11H2,1-2H3,(H,16,18)

InChI Key

PVPUZAVXGBOFGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08044139

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

310.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.518

Distribution Coefficient, logD

1.518

Water Solubility, LogSw

-2.44

Polar Surface Area

56.593

Acid Dissociation Constant (pKa)

14.41

Base Dissociation Constant (pKb)

-1.04

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

53.30

Y300-0288 in Drug Discovery

Included in Screening Libraries

CNS MPO Library (28609 compounds)

Neuropeptide S Library (2850 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Digestive system
  • Nervous system
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y300-0288 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y300-0288?
Check Price and Availability of Y300-0288, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of Y300-0288 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y300-0288
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y300-0288
  • 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 Y300-0288 available by request