1182-0090 Screening compound: N-[(E)-[1-(4-bromophenyl)ethylidene]amino]guanidine

1182-0090 Screening compound: N-[(E)-[1-(4-bromophenyl)ethylidene]amino]guanidine
1182-0090 Screening compound: N-[(E)-[1-(4-bromophenyl)ethylidene]amino]guanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 1182-0090
N-[(E)-[1-(4-bromophenyl)ethylidene]amino]guanidine

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

1182-0090

Molecular Formula

C9H11BrN4 (C9 H11 BrN4)

Compound Name

N-[(E)-[1-(4-bromophenyl)ethylidene]amino]guanidine

IUPAC name

N-[(E)-[1-(4-bromophenyl)ethylidene]amino]guanidine

SMILES

C/C(/c(cc1)ccc1Br)=N\NC(N)=N

InChI

InChI=1S/C9H11BrN4/c1-6(13-14-9(11)12)7-2-4-8(10)5-3-7/h2-5H,1H3,(H4,11,12,14)

InChI Key

HIHNDLREWUJZKX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00465944

Chemical and Physical Properties

Saltdata

HNO3

Molecular Weight

255.12

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.939

Distribution Coefficient, logD

-5.068

Water Solubility, LogSw

-1.96

Polar Surface Area

60.588

Acid Dissociation Constant (pKa)

14.66

Base Dissociation Constant (pKb)

11.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.10

1182-0090 in Drug Discovery

Included in Screening Libraries

Dark Chemical Matter Library (18430 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 1182-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1182-0090?
Check Price and Availability of 1182-0090, 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 1182-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1182-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1182-0090
  • 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 1182-0090 available by request