D724-0094 Screening compound: 3-isopropyl-1-(pentylamino)pyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

D724-0094 Screening compound: 3-isopropyl-1-(pentylamino)pyrido[1,2-a][1,3]benzimidazol-4-yl cyanide
D724-0094 Screening compound: 3-isopropyl-1-(pentylamino)pyrido[1,2-a][1,3]benzimidazol-4-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound D724-0094
3-isopropyl-1-(pentylamino)pyrido[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

D724-0094

Molecular Formula

C20H24N4 (C20 H24 N4)

Compound Name

3-isopropyl-1-(pentylamino)pyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

IUPAC name

13-(pentylamino)-11-(propan-2-yl)-18-diazatricyclo[7.4.0.0^{27}]trideca-2(7)3581012-hexaene-10-carbonitrile

SMILES

CCCCCNc(n1c2nc3c1cccc3)cc(C(C)C)c2C#N

InChI

InChI=1S/C20H24N4/c1-4-5-8-11-22-19-12-15(14(2)3)16(13-21)20-23-17-9-6-7-10-18(17)24(19)20/h6-7,9-10,12,14,22H,4-5,8,11H2,1-3H3

InChI Key

NDMPWDWXAJWJBM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03687402

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.44

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.598

Distribution Coefficient, logD

5.598

Water Solubility, LogSw

-5.50

Polar Surface Area

36.049

Acid Dissociation Constant (pKa)

18.31

Base Dissociation Constant (pKb)

4.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

References: we are preparing a list of scientific research reports with D724-0094 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D724-0094?
Check Price and Availability of D724-0094, 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 D724-0094 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D724-0094
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D724-0094
  • 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 D724-0094 available by request