4708-0150 Screening compound: 1-[(3-ethoxypropyl)amino]-2-ethyl-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

4708-0150 Screening compound: 1-[(3-ethoxypropyl)amino]-2-ethyl-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide
4708-0150 Screening compound: 1-[(3-ethoxypropyl)amino]-2-ethyl-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4708-0150
1-[(3-ethoxypropyl)amino]-2-ethyl-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

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

4708-0150

Molecular Formula

C20H24N4O (C20 H24 N4 O)

Compound Name

1-[(3-ethoxypropyl)amino]-2-ethyl-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

IUPAC name

13-[(3-ethoxypropyl)amino]-12-ethyl-11-methyl-18-diazatricyclo[7.4.0.0^{27}]trideca-2(7)3581012-hexaene-10-carbonitrile

SMILES

CCc(c(C)c1C#N)c(NCCCOCC)n2c1nc1c2cccc1

InChI

InChI=1S/C20H24N4O/c1-4-15-14(3)16(13-21)20-23-17-9-6-7-10-18(17)24(20)19(15)22-11-8-12-25-5-2/h6-7,9-10,22H,4-5,8,11-12H2,1-3H3

InChI Key

CIMJIDMSZBBZGL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01066361

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

336.44

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.561

Distribution Coefficient, logD

4.561

Water Solubility, LogSw

-4.44

Polar Surface Area

43.105

Acid Dissociation Constant (pKa)

19.14

Base Dissociation Constant (pKb)

4.53

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

4708-0150 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antifungal Library (16415 compounds)

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4708-0150 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4708-0150?
Check Price and Availability of 4708-0150, 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 4708-0150 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4708-0150
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4708-0150
  • 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 4708-0150 available by request