SB03-0268 Screening compound: 1-{2-[(1-cyclopropanecarbonylpiperidin-3-yl)(oxan-4-yl)amino]ethyl}-3-(2,5-dimethylphenyl)urea

SB03-0268 Screening compound: 1-{2-[(1-cyclopropanecarbonylpiperidin-3-yl)(oxan-4-yl)amino]ethyl}-3-(2,5-dimethylphenyl)urea
SB03-0268 Screening compound: 1-{2-[(1-cyclopropanecarbonylpiperidin-3-yl)(oxan-4-yl)amino]ethyl}-3-(2,5-dimethylphenyl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound SB03-0268
1-{2-[(1-cyclopropanecarbonylpiperidin-3-yl)(oxan-4-yl)amino]ethyl}-3-(2,5-dimethylphenyl)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

SB03-0268

Molecular Formula

C25H38N4O3 (C25 H38 N4 O3)

Compound Name

1-{2-[(1-cyclopropanecarbonylpiperidin-3-yl)(oxan-4-yl)amino]ethyl}-3-(2,5-dimethylphenyl)urea

IUPAC name

1-{2-[(1-cyclopropanecarbonylpiperidin-3-yl)(oxan-4-yl)amino]ethyl}-3-(25-dimethylphenyl)urea

SMILES

Cc1cc(NC(NCCN(C2CCOCC2)C(CCC2)CN2C(C2CC2)=O)=O)c(C)cc1

InChI

InChI=1S/C25H38N4O3/c1-18-5-6-19(2)23(16-18)27-25(31)26-11-13-29(21-9-14-32-15-10-21)22-4-3-12-28(17-22)24(30)20-7-8-20/h5-6,16,20-22H,3-4,7-15,17H2,1-2H3,(H2,26,27,31)/t22-/m0/s1

InChI Key

HEFFQHCCHLLQFG-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD32243843

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.6

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.528

Distribution Coefficient, logD

0.110

Water Solubility, LogSw

-2.85

Polar Surface Area

59.900

Acid Dissociation Constant (pKa)

13.76

Base Dissociation Constant (pKb)

9.82

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

68.00

SB03-0268 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CNS Targets (44014 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with SB03-0268 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SB03-0268?
Check Price and Availability of SB03-0268, 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 SB03-0268 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SB03-0268
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SB03-0268
  • 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 SB03-0268 available by request