8016-2720 Screening compound: N-cyclopropyl-N'-(3,4,5-trimethoxyphenyl)thiourea

8016-2720 Screening compound: N-cyclopropyl-N'-(3,4,5-trimethoxyphenyl)thiourea
8016-2720 Screening compound: N-cyclopropyl-N'-(3,4,5-trimethoxyphenyl)thiourea alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-2720
N-cyclopropyl-N'-(3,4,5-trimethoxyphenyl)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

8016-2720

Molecular Formula

C13H18N2O3S (C13 H18 N2 O3 S)

Compound Name

N-cyclopropyl-N'-(3,4,5-trimethoxyphenyl)thiourea

IUPAC name

3-cyclopropyl-1-(345-trimethoxyphenyl)thiourea

SMILES

COc1cc(NC(NC2CC2)=S)cc(OC)c1OC

InChI

InChI=1S/C13H18N2O3S/c1-16-10-6-9(7-11(17-2)12(10)18-3)15-13(19)14-8-4-5-8/h6-8H,4-5H2,1-3H3,(H2,14,15,19)

InChI Key

ONWGSRJDMZQWEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05620643

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.821

Distribution Coefficient, logD

1.821

Water Solubility, LogSw

-2.37

Polar Surface Area

43.417

Acid Dissociation Constant (pKa)

13.02

Base Dissociation Constant (pKb)

5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.15

References: we are preparing a list of scientific research reports with 8016-2720 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-2720?
Check Price and Availability of 8016-2720, 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 8016-2720 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-2720
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-2720
  • 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 8016-2720 available by request