SC12-1012 Screening compound: 3-[3-(4-methylpiperazin-1-yl)propyl]-3-(oxan-4-yl)-1-(2-phenylethyl)urea

SC12-1012 Screening compound: 3-[3-(4-methylpiperazin-1-yl)propyl]-3-(oxan-4-yl)-1-(2-phenylethyl)urea
SC12-1012 Screening compound: 3-[3-(4-methylpiperazin-1-yl)propyl]-3-(oxan-4-yl)-1-(2-phenylethyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound SC12-1012
3-[3-(4-methylpiperazin-1-yl)propyl]-3-(oxan-4-yl)-1-(2-phenylethyl)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

SC12-1012

Molecular Formula

C22H36N4O2 (C22 H36 N4 O2)

Compound Name

3-[3-(4-methylpiperazin-1-yl)propyl]-3-(oxan-4-yl)-1-(2-phenylethyl)urea

IUPAC name

3-[3-(4-methylpiperazin-1-yl)propyl]-3-(oxan-4-yl)-1-(2-phenylethyl)urea

SMILES

CN1CCN(CCCN(C2CCOCC2)C(NCCc2ccccc2)=O)CC1

InChI

InChI=1S/C22H36N4O2/c1-24-14-16-25(17-15-24)12-5-13-26(21-9-18-28-19-10-21)22(27)23-11-8-20-6-3-2-4-7-20/h2-4,6-7,21H,5,8-19H2,1H3,(H,23,27)

InChI Key

VLPJXLQSTPBRSO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32254385

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

388.55

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.871

Distribution Coefficient, logD

1.056

Water Solubility, LogSw

-2.15

Polar Surface Area

40.753

Acid Dissociation Constant (pKa)

16.33

Base Dissociation Constant (pKb)

8.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

68.18

SC12-1012 in Drug Discovery

Included in Screening Libraries

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Nervous system
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with SC12-1012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SC12-1012?
Check Price and Availability of SC12-1012, 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 SC12-1012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SC12-1012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SC12-1012
  • 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 SC12-1012 available by request