4269-3148 Screening compound: 2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-amine

4269-3148 Screening compound: 2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-amine
4269-3148 Screening compound: 2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4269-3148
2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-amine

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

4269-3148

Molecular Formula

C14H14N4 (C14 H14 N4)

Compound Name

2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-amine

IUPAC name

2-(4-ethylphenyl)-2H-123-benzotriazol-5-amine

SMILES

CCc(cc1)ccc1-n1nc(cc(cc2)N)c2n1

InChI

InChI=1S/C14H14N4/c1-2-10-3-6-12(7-4-10)18-16-13-8-5-11(15)9-14(13)17-18/h3-9H,2,15H2,1H3

InChI Key

CBEUCAOGCWMURO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02628446

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

238.29

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.323

Distribution Coefficient, logD

3.323

Water Solubility, LogSw

-3.36

Polar Surface Area

45.079

Acid Dissociation Constant (pKa)

20.06

Base Dissociation Constant (pKb)

2.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

4269-3148 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with 4269-3148 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4269-3148?
Check Price and Availability of 4269-3148, 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 4269-3148 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4269-3148
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4269-3148
  • 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 4269-3148 available by request