2159-1487 Screening compound: N-(3-chlorophenyl)-N'-isobutylurea

2159-1487 Screening compound: N-(3-chlorophenyl)-N'-isobutylurea
2159-1487 Screening compound: N-(3-chlorophenyl)-N'-isobutylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound 2159-1487
N-(3-chlorophenyl)-N'-isobutylurea

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

2159-1487

Molecular Formula

C11H15ClN2O (C11 H15 ClN2 O)

Compound Name

N-(3-chlorophenyl)-N'-isobutylurea

IUPAC name

1-(3-chlorophenyl)-3-(2-methylpropyl)urea

SMILES

CC(C)CNC(Nc1cccc(Cl)c1)=O

InChI

InChI=1S/C11H15ClN2O/c1-8(2)7-13-11(15)14-10-5-3-4-9(12)6-10/h3-6,8H,7H2,1-2H3,(H2,13,14,15)

InChI Key

KLOATSBFXVNNHE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00089388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

226.71

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

3.519

Distribution Coefficient, logD

3.519

Water Solubility, LogSw

-3.65

Polar Surface Area

34.135

Acid Dissociation Constant (pKa)

11.94

Base Dissociation Constant (pKb)

0.48

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.36

2159-1487 in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2159-1487 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2159-1487?
Check Price and Availability of 2159-1487, 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 2159-1487 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2159-1487
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2159-1487
  • 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 2159-1487 available by request