8006-4275 Screening compound: 4-[(E)-[(2-methyl-1H-indol-3-yl)methylidene]amino]phenol

8006-4275 Screening compound: 4-[(E)-[(2-methyl-1H-indol-3-yl)methylidene]amino]phenol
8006-4275 Screening compound: 4-[(E)-[(2-methyl-1H-indol-3-yl)methylidene]amino]phenol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-4275
4-[(E)-[(2-methyl-1H-indol-3-yl)methylidene]amino]phenol

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

8006-4275

Molecular Formula

C16H14N2O (C16 H14 N2 O)

Compound Name

4-[(E)-[(2-methyl-1H-indol-3-yl)methylidene]amino]phenol

IUPAC name

4-[(E)-[(2-methyl-1H-indol-3-yl)methylidene]amino]phenol

SMILES

Cc1c(/C=N/c(cc2)ccc2O)c(cccc2)c2[nH]1

InChI

InChI=1S/C16H14N2O/c1-11-15(14-4-2-3-5-16(14)18-11)10-17-12-6-8-13(19)9-7-12/h2-10,18-19H,1H3

InChI Key

CNPNCAOCVPCUOV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00556624

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

250.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.253

Distribution Coefficient, logD

3.249

Water Solubility, LogSw

-3.15

Polar Surface Area

35.909

Acid Dissociation Constant (pKa)

9.49

Base Dissociation Constant (pKb)

4.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.30

8006-4275 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8006-4275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-4275?
Check Price and Availability of 8006-4275, 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 8006-4275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-4275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-4275
  • 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 8006-4275 available by request