5785-1701 Screening compound: (E)-{[4-(dimethylamino)phenyl]methylidene}amino N-(4-methylphenyl)carbamate

5785-1701 Screening compound: (E)-{[4-(dimethylamino)phenyl]methylidene}amino N-(4-methylphenyl)carbamate
5785-1701 Screening compound: (E)-{[4-(dimethylamino)phenyl]methylidene}amino N-(4-methylphenyl)carbamate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5785-1701
(E)-{[4-(dimethylamino)phenyl]methylidene}amino N-(4-methylphenyl)carbamate

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

5785-1701

Molecular Formula

C17H19N3O2 (C17 H19 N3 O2)

Compound Name

(E)-{[4-(dimethylamino)phenyl]methylidene}amino N-(4-methylphenyl)carbamate

IUPAC name

(E)-{[4-(dimethylamino)phenyl]methylidene}amino N-(4-methylphenyl)carbamate

SMILES

Cc(cc1)ccc1NC(O/N=C/c(cc1)ccc1N(C)C)=O

InChI

InChI=1S/C17H19N3O2/c1-13-4-8-15(9-5-13)19-17(21)22-18-12-14-6-10-16(11-7-14)20(2)3/h4-12H,1-3H3,(H,19,21)

InChI Key

WJHVYQRWALIBIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03828122

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

297.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.721

Distribution Coefficient, logD

3.721

Water Solubility, LogSw

-3.96

Polar Surface Area

43.215

Acid Dissociation Constant (pKa)

11.43

Base Dissociation Constant (pKb)

8.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

5785-1701 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Eccentric PPI Library (11937 compounds)

Human Proteases Annotated Library (2868 compounds)

Human Receptors Annotated Library (5376 compounds)

Protein-Protein Interaction Library (218420 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with 5785-1701 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5785-1701?
Check Price and Availability of 5785-1701, 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 5785-1701 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5785-1701
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5785-1701
  • 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 5785-1701 available by request