D380-0390 Screening compound: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-propoxybenzamide

D380-0390 Screening compound: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-propoxybenzamide
D380-0390 Screening compound: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-propoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D380-0390
N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-propoxybenzamide

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

D380-0390

Molecular Formula

C27H28N2O3 (C27 H28 N2 O3)

Compound Name

N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-propoxybenzamide

IUPAC name

N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-propoxybenzamide

SMILES

CCCOc(cccc1)c1C(NCC(c1c[nH]c2c1cccc2)c(cc1)ccc1OC)=O

InChI

InChI=1S/C27H28N2O3/c1-3-16-32-26-11-7-5-9-22(26)27(30)29-17-23(19-12-14-20(31-2)15-13-19)24-18-28-25-10-6-4-8-21(24)25/h4-15,18,23,28H,3,16-17H2,1-2H3,(H,29,30)/t23-/m1/s1

InChI Key

HODDSRLPDIBHOA-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD12917784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

428.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.856

Distribution Coefficient, logD

5.856

Water Solubility, LogSw

-5.91

Polar Surface Area

49.299

Acid Dissociation Constant (pKa)

10.98

Base Dissociation Constant (pKb)

-2.22

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.20

D380-0390 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with D380-0390 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D380-0390?
Check Price and Availability of D380-0390, 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 D380-0390 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D380-0390
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D380-0390
  • 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 D380-0390 available by request