D117-0014 Screening compound: 1-(4-ethoxyphenyl)-3-(hexylamino)-1-(2-methoxyphenyl)-2-phenylpropan-1-ol

D117-0014 Screening compound: 1-(4-ethoxyphenyl)-3-(hexylamino)-1-(2-methoxyphenyl)-2-phenylpropan-1-ol
D117-0014 Screening compound: 1-(4-ethoxyphenyl)-3-(hexylamino)-1-(2-methoxyphenyl)-2-phenylpropan-1-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound D117-0014
1-(4-ethoxyphenyl)-3-(hexylamino)-1-(2-methoxyphenyl)-2-phenylpropan-1-ol

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

D117-0014

Molecular Formula

C30H39NO3 (C30 H39 NO3)

Compound Name

1-(4-ethoxyphenyl)-3-(hexylamino)-1-(2-methoxyphenyl)-2-phenylpropan-1-ol

IUPAC name

1-(4-ethoxyphenyl)-3-(hexylamino)-1-(2-methoxyphenyl)-2-phenylpropan-1-ol

SMILES

CCCCCCNCC(C(c(cc1)ccc1OCC)(c(cccc1)c1OC)O)c1ccccc1

InChI

InChI=1S/C30H39NO3/c1-4-6-7-13-22-31-23-28(24-14-9-8-10-15-24)30(32,27-16-11-12-17-29(27)33-3)25-18-20-26(21-19-25)34-5-2/h8-12,14-21,28,31-32H,4-7,13,22-23H2,1-3H3

InChI Key

ZPVZAMOLYBQYOF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14812098

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

461.64

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.603

Distribution Coefficient, logD

5.109

Water Solubility, LogSw

-5.74

Polar Surface Area

41.396

Acid Dissociation Constant (pKa)

14.32

Base Dissociation Constant (pKb)

8.88

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

40.00

D117-0014 in Drug Discovery

Included in Screening Libraries

Regenerative Medicine Focused Library (23016 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with D117-0014 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D117-0014?
Check Price and Availability of D117-0014, 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 D117-0014 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D117-0014
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D117-0014
  • 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 D117-0014 available by request