3966-1268 Screening compound: N-[3-(2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)-3-(2-METHOXYPHENYL)PROPYL]-N-(1-PHENYLETHYL)AMINE

3966-1268 Screening compound: N-[3-(2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)-3-(2-METHOXYPHENYL)PROPYL]-N-(1-PHENYLETHYL)AMINE
3966-1268 Screening compound: N-[3-(2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)-3-(2-METHOXYPHENYL)PROPYL]-N-(1-PHENYLETHYL)AMINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 3966-1268
N-[3-(2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)-3-(2-METHOXYPHENYL)PROPYL]-N-(1-PHENYLETHYL)AMINE

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

3966-1268

Molecular Formula

C25H35NO2 (C25 H35 NO2)

Compound Name

N-[3-(2,2-DIMETHYLTETRAHYDRO-2H-PYRAN-4-YL)-3-(2-METHOXYPHENYL)PROPYL]-N-(1-PHENYLETHYL)AMINE

IUPAC name

n/a

SMILES

CC(c1ccccc1)NCCC(C1CC(C)(C)OCC1)c(cccc1)c1OC

InChI

InChI=1S/C25H35NO2/c1-19(20-10-6-5-7-11-20)26-16-14-22(21-15-17-28-25(2,3)18-21)23-12-8-9-13-24(23)27-4/h5-13,19,21-22,26H,14-18H2,1-4H3

InChI Key

LEYZFLIHBYLOSI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02763713

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

381.56

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.451

Distribution Coefficient, logD

4.241

Water Solubility, LogSw

-5.51

Polar Surface Area

25.550

Acid Dissociation Constant (pKa)

23.79

Base Dissociation Constant (pKb)

8.58

Number of Chiral Centers

3.00

Percent sp3 carbon bonding

16.00

3966-1268 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with 3966-1268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3966-1268?
Check Price and Availability of 3966-1268, 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 3966-1268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3966-1268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3966-1268
  • 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 3966-1268 available by request