5238-0030 Screening compound: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-6-chloro-N-phenyl-2H-chromen-2-imine

5238-0030 Screening compound: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-6-chloro-N-phenyl-2H-chromen-2-imine
5238-0030 Screening compound: (2Z)-3-(1H-1,3-benzodiazol-2-yl)-6-chloro-N-phenyl-2H-chromen-2-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 5238-0030
(2Z)-3-(1H-1,3-benzodiazol-2-yl)-6-chloro-N-phenyl-2H-chromen-2-imine

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

5238-0030

Molecular Formula

C22H14ClN3O (C22 H14 ClN3 O)

Compound Name

(2Z)-3-(1H-1,3-benzodiazol-2-yl)-6-chloro-N-phenyl-2H-chromen-2-imine

IUPAC name

(2Z)-3-(1H-13-benzodiazol-2-yl)-6-chloro-N-phenyl-2H-chromen-2-imine

SMILES

Clc(cc1)cc(C=C2c3nc(cccc4)c4[nH]3)c1O/C2=N\c1ccccc1

InChI

InChI=1S/C22H14ClN3O/c23-15-10-11-20-14(12-15)13-17(21-25-18-8-4-5-9-19(18)26-21)22(27-20)24-16-6-2-1-3-7-16/h1-13H,(H,25,26)

InChI Key

HUXNLZNIJZZWEO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01594465

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

371.83

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.040

Distribution Coefficient, logD

4.121

Water Solubility, LogSw

-5.23

Polar Surface Area

34.964

Acid Dissociation Constant (pKa)

12.57

Base Dissociation Constant (pKb)

8.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

5238-0030 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with 5238-0030 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5238-0030?
Check Price and Availability of 5238-0030, 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 5238-0030 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5238-0030
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5238-0030
  • 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 5238-0030 available by request