7649-0010 Screening compound: 1-{[2-hydroxy-3-(1H-indol-1-yl)propyl](2-hydroxyethyl)amino}-3-(4-methoxyphenoxy)propan-2-ol

7649-0010 Screening compound: 1-{[2-hydroxy-3-(1H-indol-1-yl)propyl](2-hydroxyethyl)amino}-3-(4-methoxyphenoxy)propan-2-ol
7649-0010 Screening compound: 1-{[2-hydroxy-3-(1H-indol-1-yl)propyl](2-hydroxyethyl)amino}-3-(4-methoxyphenoxy)propan-2-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 7649-0010
1-{[2-hydroxy-3-(1H-indol-1-yl)propyl](2-hydroxyethyl)amino}-3-(4-methoxyphenoxy)propan-2-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

7649-0010

Molecular Formula

C23H30N2O5 (C23 H30 N2 O5)

Compound Name

1-{[2-hydroxy-3-(1H-indol-1-yl)propyl](2-hydroxyethyl)amino}-3-(4-methoxyphenoxy)propan-2-ol

IUPAC name

1-{[2-hydroxy-3-(1H-indol-1-yl)propyl](2-hydroxyethyl)amino}-3-(4-methoxyphenoxy)propan-2-ol

SMILES

COc(cc1)ccc1OCC(CN(CCO)CC(Cn(cc1)c2c1cccc2)O)O

InChI

InChI=1S/C23H30N2O5/c1-29-21-6-8-22(9-7-21)30-17-20(28)15-24(12-13-26)14-19(27)16-25-11-10-18-4-2-3-5-23(18)25/h2-11,19-20,26-28H,12-17H2,1H3

InChI Key

RDLCNKMHHWWUDK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06405540

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.5

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.635

Distribution Coefficient, logD

2.589

Water Solubility, LogSw

-2.49

Polar Surface Area

70.977

Acid Dissociation Constant (pKa)

14.86

Base Dissociation Constant (pKb)

6.45

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

39.10

7649-0010 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

CNS targets activity set (6557 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 7649-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7649-0010?
Check Price and Availability of 7649-0010, 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 7649-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7649-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7649-0010
  • 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 7649-0010 available by request