3902-0733 Screening compound: (3E)-3-[(2-cyanoacetamido)imino]-N-(2-methoxyethyl)butanamide

3902-0733 Screening compound: (3E)-3-[(2-cyanoacetamido)imino]-N-(2-methoxyethyl)butanamide
3902-0733 Screening compound: (3E)-3-[(2-cyanoacetamido)imino]-N-(2-methoxyethyl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3902-0733
(3E)-3-[(2-cyanoacetamido)imino]-N-(2-methoxyethyl)butanamide

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

3902-0733

Molecular Formula

C10H16N4O3 (C10 H16 N4 O3)

Compound Name

(3E)-3-[(2-cyanoacetamido)imino]-N-(2-methoxyethyl)butanamide

IUPAC name

(3E)-3-[(2-cyanoacetamido)imino]-N-(2-methoxyethyl)butanamide

SMILES

C/C(/CC(NCCOC)=O)=N\NC(CC#N)=O

InChI

InChI=1S/C10H16N4O3/c1-8(13-14-9(15)3-4-11)7-10(16)12-5-6-17-2/h3,5-7H2,1-2H3,(H,12,16)(H,14,15)

InChI Key

UXRLZONJWQSSEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01895102

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.26

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

-1.232

Distribution Coefficient, logD

-1.255

Water Solubility, LogSw

-0.02

Polar Surface Area

85.400

Acid Dissociation Constant (pKa)

8.67

Base Dissociation Constant (pKb)

5.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

60.00

3902-0733 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 3902-0733 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3902-0733?
Check Price and Availability of 3902-0733, 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 3902-0733 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3902-0733
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3902-0733
  • 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 3902-0733 available by request