J049-0836 Screening compound: 7-(morpholinocarbonyl)-4-propyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione

J049-0836 Screening compound: 7-(morpholinocarbonyl)-4-propyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
J049-0836 Screening compound: 7-(morpholinocarbonyl)-4-propyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound J049-0836
7-(morpholinocarbonyl)-4-propyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione

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

J049-0836

Molecular Formula

C15H19N3O4S (C15 H19 N3 O4 S)

Compound Name

7-(morpholinocarbonyl)-4-propyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione

IUPAC name

7-(morpholine-4-carbonyl)-4-propyl-4H-1lambda624-benzothiadiazine-11-dione

SMILES

CCCN(C=N1)c(ccc(C(N2CCOCC2)=O)c2)c2S1(=O)=O

InChI

InChI=1S/C15H19N3O4S/c1-2-5-18-11-16-23(20,21)14-10-12(3-4-13(14)18)15(19)17-6-8-22-9-7-17/h3-4,10-11H,2,5-9H2,1H3

InChI Key

ZEJYEBAERTZVHW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15079440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

337.4

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.586

Distribution Coefficient, logD

0.586

Water Solubility, LogSw

-2.17

Polar Surface Area

68.272

Acid Dissociation Constant (pKa)

27.49

Base Dissociation Constant (pKb)

0.67

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.70

References: we are preparing a list of scientific research reports with J049-0836 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J049-0836?
Check Price and Availability of J049-0836, 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 J049-0836 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J049-0836
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J049-0836
  • 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 J049-0836 available by request