4269-3141 Screening compound: 3-(5-CHLORO-1,3-BENZOXAZOL-2-YL)-2-METHYLANILINE

4269-3141 Screening compound: 3-(5-CHLORO-1,3-BENZOXAZOL-2-YL)-2-METHYLANILINE
4269-3141 Screening compound: 3-(5-CHLORO-1,3-BENZOXAZOL-2-YL)-2-METHYLANILINE alternative view

Chemical Structure Depiction of ChemDiv screening compound 4269-3141
3-(5-CHLORO-1,3-BENZOXAZOL-2-YL)-2-METHYLANILINE

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

4269-3141

Molecular Formula

C14H11ClN2O (C14 H11 ClN2 O)

Compound Name

3-(5-CHLORO-1,3-BENZOXAZOL-2-YL)-2-METHYLANILINE

IUPAC name

n/a

SMILES

Cc(c(N)ccc1)c1-c1nc(cc(cc2)Cl)c2o1

InChI

InChI=1S/C14H11ClN2O/c1-8-10(3-2-4-11(8)16)14-17-12-7-9(15)5-6-13(12)18-14/h2-7H,16H2,1H3

InChI Key

YVVRPSCZEVIZRT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02628442

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

258.71

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.769

Distribution Coefficient, logD

3.769

Water Solubility, LogSw

-4.21

Polar Surface Area

37.145

Acid Dissociation Constant (pKa)

22.83

Base Dissociation Constant (pKb)

5.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

4269-3141 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 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 4269-3141 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4269-3141?
Check Price and Availability of 4269-3141, 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 4269-3141 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4269-3141
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4269-3141
  • 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 4269-3141 available by request