C795-2326 Screening compound: 1-(4-methoxyphenyl)-3-{1-methyl-2-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-5-yl}urea

C795-2326 Screening compound: 1-(4-methoxyphenyl)-3-{1-methyl-2-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-5-yl}urea
C795-2326 Screening compound: 1-(4-methoxyphenyl)-3-{1-methyl-2-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-5-yl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C795-2326
1-(4-methoxyphenyl)-3-{1-methyl-2-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-5-yl}urea

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

C795-2326

Molecular Formula

C24H24N4O2 (C24 H24 N4 O2)

Compound Name

1-(4-methoxyphenyl)-3-{1-methyl-2-[(2-methylphenyl)methyl]-1H-1,3-benzodiazol-5-yl}urea

IUPAC name

1-(4-methoxyphenyl)-3-{1-methyl-2-[(2-methylphenyl)methyl]-1H-13-benzodiazol-5-yl}urea

SMILES

Cc1c(Cc2nc(cc(cc3)NC(Nc(cc4)ccc4OC)=O)c3n2C)cccc1

InChI

InChI=1S/C24H24N4O2/c1-16-6-4-5-7-17(16)14-23-27-21-15-19(10-13-22(21)28(23)2)26-24(29)25-18-8-11-20(30-3)12-9-18/h4-13,15H,14H2,1-3H3,(H2,25,26,29)

InChI Key

LWLHAHQJPOTACD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14797383

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

400.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.822

Distribution Coefficient, logD

5.815

Water Solubility, LogSw

-5.47

Polar Surface Area

51.800

Acid Dissociation Constant (pKa)

13.22

Base Dissociation Constant (pKb)

5.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

C795-2326 in Drug Discovery

Included in Screening Libraries

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

Cardiovascular Library (22201 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C795-2326 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C795-2326?
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What is the minimum amount of C795-2326 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C795-2326
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C795-2326
  • 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 C795-2326 available by request