K788-1895 Screening compound: 3-[(Z)-({4-[butyl(ethyl)amino]phenyl}methylidene)amino]-1-(3-methoxyphenyl)thiourea

K788-1895 Screening compound: 3-[(Z)-({4-[butyl(ethyl)amino]phenyl}methylidene)amino]-1-(3-methoxyphenyl)thiourea
K788-1895 Screening compound: 3-[(Z)-({4-[butyl(ethyl)amino]phenyl}methylidene)amino]-1-(3-methoxyphenyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound K788-1895
3-[(Z)-({4-[butyl(ethyl)amino]phenyl}methylidene)amino]-1-(3-methoxyphenyl)thiourea

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

K788-1895

Molecular Formula

C21H28N4OS (C21 H28 N4 OS)

Compound Name

3-[(Z)-({4-[butyl(ethyl)amino]phenyl}methylidene)amino]-1-(3-methoxyphenyl)thiourea

IUPAC name

3-[(Z)-({4-[butyl(ethyl)amino]phenyl}methylidene)amino]-1-(3-methoxyphenyl)thiourea

SMILES

CCCCN(CC)c1ccc(/C=N\NC(Nc2cc(OC)ccc2)=S)cc1

InChI

InChI=1S/C21H28N4OS/c1-4-6-14-25(5-2)19-12-10-17(11-13-19)16-22-24-21(27)23-18-8-7-9-20(15-18)26-3/h7-13,15-16H,4-6,14H2,1-3H3,(H2,23,24,27)

InChI Key

BEDSCAZKCAMOCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15103440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.55

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.830

Distribution Coefficient, logD

5.828

Water Solubility, LogSw

-5.55

Polar Surface Area

41.819

Acid Dissociation Constant (pKa)

12.87

Base Dissociation Constant (pKb)

8.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with K788-1895 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K788-1895?
Check Price and Availability of K788-1895, 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 K788-1895 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K788-1895
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K788-1895
  • 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 K788-1895 available by request