2684-0659 Screening compound: N-{[1-(4-methylbenzenesulfonyl)azetidin-3-ylidene]amino}guanidine

2684-0659 Screening compound: N-{[1-(4-methylbenzenesulfonyl)azetidin-3-ylidene]amino}guanidine
2684-0659 Screening compound: N-{[1-(4-methylbenzenesulfonyl)azetidin-3-ylidene]amino}guanidine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2684-0659
N-{[1-(4-methylbenzenesulfonyl)azetidin-3-ylidene]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

2684-0659

Molecular Formula

C11H15N5O2S (C11 H15 N5 O2 S)

Compound Name

N-{[1-(4-methylbenzenesulfonyl)azetidin-3-ylidene]amino}guanidine

IUPAC name

N-{[1-(4-methylbenzenesulfonyl)azetidin-3-ylidene]amino}guanidine

SMILES

Cc(cc1)ccc1S(N(C1)CC1=NNC(N)=N)(=O)=O

InChI

InChI=1S/C11H15N5O2S/c1-8-2-4-10(5-3-8)19(17,18)16-6-9(7-16)14-15-11(12)13/h2-5H,6-7H2,1H3,(H4,12,13,15)

InChI Key

MCFNXOVUZUSJNQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14708323

Chemical and Physical Properties

Saltdata

HNO3

Molecular Weight

281.34

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.396

Distribution Coefficient, logD

-5.802

Water Solubility, LogSw

-2.42

Polar Surface Area

93.245

Acid Dissociation Constant (pKa)

14.40

Base Dissociation Constant (pKb)

10.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

2684-0659 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 2684-0659 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2684-0659?
Check Price and Availability of 2684-0659, 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 2684-0659 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2684-0659
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2684-0659
  • 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 2684-0659 available by request