C270-0541 Screening compound: 1-(3-chloro-4-methylphenyl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea

C270-0541 Screening compound: 1-(3-chloro-4-methylphenyl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea
C270-0541 Screening compound: 1-(3-chloro-4-methylphenyl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea alternative view

Chemical Structure Depiction of ChemDiv screening compound C270-0541
1-(3-chloro-4-methylphenyl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea

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

C270-0541

Molecular Formula

C21H27ClN4O2 (C21 H27 ClN4 O2)

Compound Name

1-(3-chloro-4-methylphenyl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea

IUPAC name

1-(3-chloro-4-methylphenyl)-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl}urea

SMILES

Cc(ccc(NC(NCCN(CC1)CCN1c(cc1)ccc1OC)=O)c1)c1Cl

InChI

InChI=1S/C21H27ClN4O2/c1-16-3-4-17(15-20(16)22)24-21(27)23-9-10-25-11-13-26(14-12-25)18-5-7-19(28-2)8-6-18/h3-8,15H,9-14H2,1-2H3,(H2,23,24,27)

InChI Key

UWKVGNAWYBCJTH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14739887

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.92

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.427

Distribution Coefficient, logD

3.539

Water Solubility, LogSw

-4.55

Polar Surface Area

48.492

Acid Dissociation Constant (pKa)

11.82

Base Dissociation Constant (pKb)

8.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.10

C270-0541 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C270-0541 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C270-0541?
Check Price and Availability of C270-0541, 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 C270-0541 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C270-0541
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C270-0541
  • 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 C270-0541 available by request