V028-6246 Screening compound: N-[2-(diethylamino)-4-oxo-4H-1,3-benzothiazin-6-yl]-3-nitrobenzamide

V028-6246 Screening compound: N-[2-(diethylamino)-4-oxo-4H-1,3-benzothiazin-6-yl]-3-nitrobenzamide
V028-6246 Screening compound: N-[2-(diethylamino)-4-oxo-4H-1,3-benzothiazin-6-yl]-3-nitrobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V028-6246
N-[2-(diethylamino)-4-oxo-4H-1,3-benzothiazin-6-yl]-3-nitrobenzamide

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

V028-6246

Molecular Formula

C19H18N4O4S (C19 H18 N4 O4 S)

Compound Name

N-[2-(diethylamino)-4-oxo-4H-1,3-benzothiazin-6-yl]-3-nitrobenzamide

IUPAC name

N-[2-(diethylamino)-4-oxo-4H-13-benzothiazin-6-yl]-3-nitrobenzamide

SMILES

CCN(CC)C(Sc(cc1)c2cc1NC(c1cc([N+]([O-])=O)ccc1)=O)=NC2=O

InChI

InChI=1S/C19H18N4O4S/c1-3-22(4-2)19-21-18(25)15-11-13(8-9-16(15)28-19)20-17(24)12-6-5-7-14(10-12)23(26)27/h5-11H,3-4H2,1-2H3,(H,20,24)

InChI Key

IONIWMFWZWDKLQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14289407

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

398.44

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.581

Distribution Coefficient, logD

3.549

Water Solubility, LogSw

-3.84

Polar Surface Area

80.986

Acid Dissociation Constant (pKa)

8.52

Base Dissociation Constant (pKb)

2.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.10

References: we are preparing a list of scientific research reports with V028-6246 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V028-6246?
Check Price and Availability of V028-6246, 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 V028-6246 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V028-6246
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V028-6246
  • 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 V028-6246 available by request