2910-2540 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-bromo-3-methylaniline

2910-2540 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-bromo-3-methylaniline
2910-2540 Screening compound: N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-bromo-3-methylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 2910-2540
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-bromo-3-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

2910-2540

Molecular Formula

C15H14BrNO2 (C15 H14 BrNO2)

Compound Name

N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-bromo-3-methylaniline

IUPAC name

N-[(2H-13-benzodioxol-5-yl)methyl]-4-bromo-3-methylaniline

SMILES

Cc(cc(cc1)NCc(cc2)cc3c2OCO3)c1Br

InChI

InChI=1S/C15H14BrNO2/c1-10-6-12(3-4-13(10)16)17-8-11-2-5-14-15(7-11)19-9-18-14/h2-7,17H,8-9H2,1H3

InChI Key

JMCQMZXBTAQHAD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00954996

Chemical and Physical Properties

Saltdata

HOOCCOOH

Molecular Weight

320.19

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.259

Distribution Coefficient, logD

4.259

Water Solubility, LogSw

-4.38

Polar Surface Area

27.588

Acid Dissociation Constant (pKa)

19.85

Base Dissociation Constant (pKb)

8.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

2910-2540 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 2910-2540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2910-2540?
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What is the minimum amount of 2910-2540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2910-2540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2910-2540
  • 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 2910-2540 available by request