3455-2700 Screening compound: ethyl 1-(3,4-dimethylbenzoyl)piperidine-4-carboxylate

3455-2700 Screening compound: ethyl 1-(3,4-dimethylbenzoyl)piperidine-4-carboxylate
3455-2700 Screening compound: ethyl 1-(3,4-dimethylbenzoyl)piperidine-4-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3455-2700
ethyl 1-(3,4-dimethylbenzoyl)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

3455-2700

Molecular Formula

C17H23NO3 (C17 H23 NO3)

Compound Name

ethyl 1-(3,4-dimethylbenzoyl)piperidine-4-carboxylate

IUPAC name

ethyl 1-(34-dimethylbenzoyl)piperidine-4-carboxylate

SMILES

CCOC(C(CC1)CCN1C(c1cc(C)c(C)cc1)=O)=O

InChI

InChI=1S/C17H23NO3/c1-4-21-17(20)14-7-9-18(10-8-14)16(19)15-6-5-12(2)13(3)11-15/h5-6,11,14H,4,7-10H2,1-3H3

InChI Key

PVLZNQXTYVAIPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01216008

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.916

Distribution Coefficient, logD

2.916

Water Solubility, LogSw

-2.86

Polar Surface Area

37.640

Acid Dissociation Constant (pKa)

23.24

Base Dissociation Constant (pKb)

-2.09

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.90

References: we are preparing a list of scientific research reports with 3455-2700 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3455-2700?
Check Price and Availability of 3455-2700, 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 3455-2700 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3455-2700
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3455-2700
  • 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 3455-2700 available by request