K906-4425 Screening compound: 6-[4-(morpholin-4-yl)-4-oxobutane-2-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one

K906-4425 Screening compound: 6-[4-(morpholin-4-yl)-4-oxobutane-2-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one
K906-4425 Screening compound: 6-[4-(morpholin-4-yl)-4-oxobutane-2-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-4425
6-[4-(morpholin-4-yl)-4-oxobutane-2-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one

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

K906-4425

Molecular Formula

C16H20N2O5S2 (C16 H20 N2 O5 S2)

Compound Name

6-[4-(morpholin-4-yl)-4-oxobutane-2-sulfonyl]-3,4-dihydro-2H-1,4-benzothiazin-3-one

IUPAC name

6-[4-(morpholin-4-yl)-4-oxobutane-2-sulfonyl]-34-dihydro-2H-14-benzothiazin-3-one

SMILES

CC(CC(N1CCOCC1)=O)S(c(cc1)cc(N2)c1SCC2=O)(=O)=O

InChI

InChI=1S/C16H20N2O5S2/c1-11(8-16(20)18-4-6-23-7-5-18)25(21,22)12-2-3-14-13(9-12)17-15(19)10-24-14/h2-3,9,11H,4-8,10H2,1H3,(H,17,19)/t11-/m0/s1

InChI Key

ANPGZCLPWLLUCK-NSHDSACASA-N

MDL Number (MFCD)

MFCD15113715

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.066

Distribution Coefficient, logD

0.066

Water Solubility, LogSw

-2.52

Polar Surface Area

78.861

Acid Dissociation Constant (pKa)

12.25

Base Dissociation Constant (pKb)

-3.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

50.00

K906-4425 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS MPO Library (28609 compounds)

KRAS-Targeted Library (16000 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with K906-4425 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-4425?
Check Price and Availability of K906-4425, 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 K906-4425 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-4425
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-4425
  • 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 K906-4425 available by request