E641-2301 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(2,3-dimethylphenyl)-1-[(5-methylfuran-2-yl)methyl]urea

E641-2301 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(2,3-dimethylphenyl)-1-[(5-methylfuran-2-yl)methyl]urea
E641-2301 Screening compound: 1-(1-benzylpiperidin-4-yl)-3-(2,3-dimethylphenyl)-1-[(5-methylfuran-2-yl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound E641-2301
1-(1-benzylpiperidin-4-yl)-3-(2,3-dimethylphenyl)-1-[(5-methylfuran-2-yl)methyl]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

E641-2301

Molecular Formula

C27H33N3O2 (C27 H33 N3 O2)

Compound Name

1-(1-benzylpiperidin-4-yl)-3-(2,3-dimethylphenyl)-1-[(5-methylfuran-2-yl)methyl]urea

IUPAC name

1-(1-benzylpiperidin-4-yl)-3-(23-dimethylphenyl)-1-[(5-methylfuran-2-yl)methyl]urea

SMILES

Cc1ccc(CN(C2CCN(Cc3ccccc3)CC2)C(Nc2c(C)c(C)ccc2)=O)o1

InChI

InChI=1S/C27H33N3O2/c1-20-8-7-11-26(22(20)3)28-27(31)30(19-25-13-12-21(2)32-25)24-14-16-29(17-15-24)18-23-9-5-4-6-10-23/h4-13,24H,14-19H2,1-3H3,(H,28,31)

InChI Key

STBBGVJOHAQRIL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14906415

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.018

Distribution Coefficient, logD

5.171

Water Solubility, LogSw

-5.50

Polar Surface Area

34.349

Acid Dissociation Constant (pKa)

14.50

Base Dissociation Constant (pKb)

8.18

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.00

References: we are preparing a list of scientific research reports with E641-2301 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E641-2301?
Check Price and Availability of E641-2301, 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 E641-2301 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E641-2301
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E641-2301
  • 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 E641-2301 available by request