C699-1511 Screening compound: N-(1-benzylpiperidin-4-yl)-4-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

C699-1511 Screening compound: N-(1-benzylpiperidin-4-yl)-4-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide
C699-1511 Screening compound: N-(1-benzylpiperidin-4-yl)-4-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C699-1511
N-(1-benzylpiperidin-4-yl)-4-methyl-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

C699-1511

Molecular Formula

C22H27N3OS (C22 H27 N3 OS)

Compound Name

N-(1-benzylpiperidin-4-yl)-4-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide

IUPAC name

N-(1-benzylpiperidin-4-yl)-4-methyl-34-dihydro-2H-14-benzothiazine-6-carboxamide

SMILES

CN1c(cc(cc2)C(NC3CCN(Cc4ccccc4)CC3)=O)c2SCC1

InChI

InChI=1S/C22H27N3OS/c1-24-13-14-27-21-8-7-18(15-20(21)24)22(26)23-19-9-11-25(12-10-19)16-17-5-3-2-4-6-17/h2-8,15,19H,9-14,16H2,1H3,(H,23,26)

InChI Key

QMXBSQHMRJELBX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14784374

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.994

Distribution Coefficient, logD

1.549

Water Solubility, LogSw

-3.54

Polar Surface Area

30.467

Acid Dissociation Constant (pKa)

16.47

Base Dissociation Constant (pKb)

8.83

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.90

C699-1511 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

GPCR Targeted Library (31838 compounds)

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with C699-1511 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C699-1511?
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What is the minimum amount of C699-1511 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C699-1511
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C699-1511
  • 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 C699-1511 available by request