E699-3162 Screening compound: N-(3-chlorophenyl)-3-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]butanamide

E699-3162 Screening compound: N-(3-chlorophenyl)-3-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]butanamide
E699-3162 Screening compound: N-(3-chlorophenyl)-3-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E699-3162
N-(3-chlorophenyl)-3-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]butanamide

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

E699-3162

Molecular Formula

C19H19ClN2O4S2 (C19 H19 ClN2 O4 S2)

Compound Name

N-(3-chlorophenyl)-3-[(2-methyl-3-oxo-3,4-dihydro-2H-1,4-benzothiazin-6-yl)sulfonyl]butanamide

IUPAC name

N-(3-chlorophenyl)-3-[(2-methyl-3-oxo-34-dihydro-2H-14-benzothiazin-6-yl)sulfonyl]butanamide

SMILES

CC(CC(Nc1cccc(Cl)c1)=O)S(c(cc1)cc(N2)c1SC(C)C2=O)(=O)=O

InChI

InChI=1S/C19H19ClN2O4S2/c1-11(8-18(23)21-14-5-3-4-13(20)9-14)28(25,26)15-6-7-17-16(10-15)22-19(24)12(2)27-17/h3-7,9-12H,8H2,1-2H3,(H,21,23)(H,22,24)

InChI Key

QTAKMUNPCSHZAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14911002

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.96

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.593

Distribution Coefficient, logD

3.591

Water Solubility, LogSw

-3.62

Polar Surface Area

77.766

Acid Dissociation Constant (pKa)

9.69

Base Dissociation Constant (pKb)

-2.31

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

26.30

References: we are preparing a list of scientific research reports with E699-3162 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E699-3162?
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What is the minimum amount of E699-3162 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E699-3162
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E699-3162
  • 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 E699-3162 available by request