D724-0173 Screening compound: 3-methyl-1-[(2-morpholinoethyl)amino]-2-propylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

D724-0173 Screening compound: 3-methyl-1-[(2-morpholinoethyl)amino]-2-propylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide
D724-0173 Screening compound: 3-methyl-1-[(2-morpholinoethyl)amino]-2-propylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound D724-0173
3-methyl-1-[(2-morpholinoethyl)amino]-2-propylpyrido[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

D724-0173

Molecular Formula

C22H27N5O (C22 H27 N5 O)

Compound Name

3-methyl-1-[(2-morpholinoethyl)amino]-2-propylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

IUPAC name

11-methyl-13-{[2-(morpholin-4-yl)ethyl]amino}-12-propyl-18-diazatricyclo[7.4.0.0^{27}]trideca-2(7)3581012-hexaene-10-carbonitrile

SMILES

CCCc(c(C)c1C#N)c(NCCN2CCOCC2)n2c1nc1c2cccc1

InChI

InChI=1S/C22H27N5O/c1-3-6-17-16(2)18(15-23)22-25-19-7-4-5-8-20(19)27(22)21(17)24-9-10-26-11-13-28-14-12-26/h4-5,7-8,24H,3,6,9-14H2,1-2H3

InChI Key

MKEOZYFNQWITDB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05686133

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.202

Distribution Coefficient, logD

3.565

Water Solubility, LogSw

-4.22

Polar Surface Area

46.747

Acid Dissociation Constant (pKa)

17.42

Base Dissociation Constant (pKb)

7.92

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

D724-0173 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antifungal Library (16415 compounds)

PI3K-Targeted Library (17255 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Infections
  • Immune system
  • animal
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Agro:
  • Agro
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with D724-0173 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D724-0173?
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What is the minimum amount of D724-0173 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D724-0173
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D724-0173
  • 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 D724-0173 available by request