G801-0236 Screening compound: ethyl 1-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)sulfonyl]piperidine-4-carboxylate

G801-0236 Screening compound: ethyl 1-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)sulfonyl]piperidine-4-carboxylate
G801-0236 Screening compound: ethyl 1-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)sulfonyl]piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound G801-0236
ethyl 1-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)sulfonyl]piperidine-4-carboxylate

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

G801-0236

Molecular Formula

C17H23N3O5S (C17 H23 N3 O5 S)

Compound Name

ethyl 1-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)sulfonyl]piperidine-4-carboxylate

IUPAC name

ethyl 1-[(13-dimethyl-2-oxo-23-dihydro-1H-13-benzodiazol-5-yl)sulfonyl]piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1S(c(cc1)cc(N2C)c1N(C)C2=O)(=O)=O)=O

InChI

InChI=1S/C17H23N3O5S/c1-4-25-16(21)12-7-9-20(10-8-12)26(23,24)13-5-6-14-15(11-13)19(3)17(22)18(14)2/h5-6,11-12H,4,7-10H2,1-3H3

InChI Key

IWTQJNMVOZAMRA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27160863

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.45

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.952

Distribution Coefficient, logD

1.952

Water Solubility, LogSw

-2.73

Polar Surface Area

70.388

Acid Dissociation Constant (pKa)

23.25

Base Dissociation Constant (pKb)

-2.45

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.90

G801-0236 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

CNS MPO Library (28609 compounds)

Hsp90-Targeted Library (11355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Nervous system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with G801-0236 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G801-0236?
Check Price and Availability of G801-0236, 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 G801-0236 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G801-0236
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G801-0236
  • 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 G801-0236 available by request