C699-1774 Screening compound: N-(2-chloro-4-methylphenyl)-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C699-1774 Screening compound: N-(2-chloro-4-methylphenyl)-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C699-1774 Screening compound: N-(2-chloro-4-methylphenyl)-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C699-1774
N-(2-chloro-4-methylphenyl)-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

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

C699-1774

Molecular Formula

C18H19ClN2OS (C18 H19 ClN2 OS)

Compound Name

N-(2-chloro-4-methylphenyl)-4-ethyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

N-(2-chloro-4-methylphenyl)-4-ethyl-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CCN1c(cc(cc2)C(Nc(ccc(C)c3)c3Cl)=O)c2SCC1

InChI

InChI=1S/C18H19ClN2OS/c1-3-21-8-9-23-17-7-5-13(11-16(17)21)18(22)20-15-6-4-12(2)10-14(15)19/h4-7,10-11H,3,8-9H2,1-2H3,(H,20,22)

InChI Key

ZZUINYOPSMLQLY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14784439

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.88

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.535

Distribution Coefficient, logD

4.535

Water Solubility, LogSw

-4.57

Polar Surface Area

25.191

Acid Dissociation Constant (pKa)

10.85

Base Dissociation Constant (pKb)

2.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.80

References: we are preparing a list of scientific research reports with C699-1774 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C699-1774?
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What is the minimum amount of C699-1774 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C699-1774
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C699-1774
  • 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 C699-1774 available by request