S776-0370 Screening compound: 1-cyclopropanecarbonyl-4-[2-(2,5-dimethyl-1H-imidazol-1-yl)ethyl]piperidine

S776-0370 Screening compound: 1-cyclopropanecarbonyl-4-[2-(2,5-dimethyl-1H-imidazol-1-yl)ethyl]piperidine
S776-0370 Screening compound: 1-cyclopropanecarbonyl-4-[2-(2,5-dimethyl-1H-imidazol-1-yl)ethyl]piperidine alternative view

Chemical Structure Depiction of ChemDiv screening compound S776-0370
1-cyclopropanecarbonyl-4-[2-(2,5-dimethyl-1H-imidazol-1-yl)ethyl]piperidine

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

S776-0370

Molecular Formula

C16H25N3O (C16 H25 N3 O)

Compound Name

1-cyclopropanecarbonyl-4-[2-(2,5-dimethyl-1H-imidazol-1-yl)ethyl]piperidine

IUPAC name

1-cyclopropanecarbonyl-4-[2-(25-dimethyl-1H-imidazol-1-yl)ethyl]piperidine

SMILES

Cc1cnc(C)n1CCC(CC1)CCN1C(C1CC1)=O

InChI

InChI=1S/C16H25N3O/c1-12-11-17-13(2)19(12)10-7-14-5-8-18(9-6-14)16(20)15-3-4-15/h11,14-15H,3-10H2,1-2H3

InChI Key

DLCZRLLWKKZKFU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD31966916

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

275.39

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.189

Distribution Coefficient, logD

0.812

Water Solubility, LogSw

-1.89

Polar Surface Area

29.350

Acid Dissociation Constant (pKa)

22.91

Base Dissociation Constant (pKb)

8.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

75.00

S776-0370 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

CNS BBB Library (22607 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with S776-0370 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S776-0370?
Check Price and Availability of S776-0370, 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 S776-0370 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S776-0370
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S776-0370
  • 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 S776-0370 available by request