G404-0855 Screening compound: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carboxamide

G404-0855 Screening compound: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carboxamide
G404-0855 Screening compound: N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G404-0855
N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-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

G404-0855

Molecular Formula

C17H18ClN5O3S2 (C17 H18 ClN5 O3 S2)

Compound Name

N-(6-chloro-1,3-benzothiazol-2-yl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carboxamide

IUPAC name

N-(6-chloro-13-benzothiazol-2-yl)-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]piperidine-3-carboxamide

SMILES

Cn1cnc(S(N(CCC2)CC2C(Nc2nc(ccc(Cl)c3)c3s2)=O)(=O)=O)c1

InChI

InChI=1S/C17H18ClN5O3S2/c1-22-9-15(19-10-22)28(25,26)23-6-2-3-11(8-23)16(24)21-17-20-13-5-4-12(18)7-14(13)27-17/h4-5,7,9-11H,2-3,6,8H2,1H3,(H,20,21,24)/t11-/m0/s1

InChI Key

FUCWHMITZVWTSJ-NSHDSACASA-N

MDL Number (MFCD)

MFCD15009667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

439.95

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.348

Distribution Coefficient, logD

2.340

Water Solubility, LogSw

-3.37

Polar Surface Area

77.147

Acid Dissociation Constant (pKa)

9.12

Base Dissociation Constant (pKb)

-0.17

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.30

G404-0855 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with G404-0855 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G404-0855?
Check Price and Availability of G404-0855, 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 G404-0855 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G404-0855
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G404-0855
  • 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 G404-0855 available by request