1184-1999 Screening compound: 1-hydroxy-2-{[(4-iodophenyl)imino]methyl}-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

1184-1999 Screening compound: 1-hydroxy-2-{[(4-iodophenyl)imino]methyl}-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide
1184-1999 Screening compound: 1-hydroxy-2-{[(4-iodophenyl)imino]methyl}-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1184-1999
1-hydroxy-2-{[(4-iodophenyl)imino]methyl}-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

1184-1999

Molecular Formula

C20H13IN4O (C20 H13 IN4 O)

Compound Name

1-hydroxy-2-{[(4-iodophenyl)imino]methyl}-3-methylpyrido[1,2-a][1,3]benzimidazol-4-yl cyanide

IUPAC name

13-hydroxy-12-[(E)-[(4-iodophenyl)imino]methyl]-11-methyl-18-diazatricyclo[7.4.0.0^{27}]trideca-2(7)3581012-hexaene-10-carbonitrile

SMILES

Cc(c(/C=N/c(cc1)ccc1I)c(n1c2nc3c1cccc3)O)c2C#N

InChI

InChI=1S/C20H13IN4O/c1-12-15(10-22)19-24-17-4-2-3-5-18(17)25(19)20(26)16(12)11-23-14-8-6-13(21)7-9-14/h2-9,11,26H,1H3

InChI Key

ASXVLRYCEPGIBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00470217

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.25

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.979

Distribution Coefficient, logD

0.704

Water Solubility, LogSw

-4.68

Polar Surface Area

48.667

Acid Dissociation Constant (pKa)

3.13

Base Dissociation Constant (pKb)

4.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.00

References: we are preparing a list of scientific research reports with 1184-1999 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1184-1999?
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What is the minimum amount of 1184-1999 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1184-1999
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1184-1999
  • 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 1184-1999 available by request