5276-0948 Screening compound: 4-[1,3-bis({[4-(dimethylamino)phenyl]methyl})imidazolidin-2-yl]-N,N-dimethylaniline

5276-0948 Screening compound: 4-[1,3-bis({[4-(dimethylamino)phenyl]methyl})imidazolidin-2-yl]-N,N-dimethylaniline
5276-0948 Screening compound: 4-[1,3-bis({[4-(dimethylamino)phenyl]methyl})imidazolidin-2-yl]-N,N-dimethylaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 5276-0948
4-[1,3-bis({[4-(dimethylamino)phenyl]methyl})imidazolidin-2-yl]-N,N-dimethylaniline

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

5276-0948

Molecular Formula

C29H39N5 (C29 H39 N5)

Compound Name

4-[1,3-bis({[4-(dimethylamino)phenyl]methyl})imidazolidin-2-yl]-N,N-dimethylaniline

IUPAC name

4-[13-bis({[4-(dimethylamino)phenyl]methyl})imidazolidin-2-yl]-NN-dimethylaniline

SMILES

CN(C)c1ccc(CN2C(c(cc3)ccc3N(C)C)N(Cc(cc3)ccc3N(C)C)CC2)cc1

InChI

InChI=1S/C29H39N5/c1-30(2)26-13-7-23(8-14-26)21-33-19-20-34(22-24-9-15-27(16-10-24)31(3)4)29(33)25-11-17-28(18-12-25)32(5)6/h7-18,29H,19-22H2,1-6H3

InChI Key

HDQYASUIPBUCDA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00980565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.66

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

5.040

Distribution Coefficient, logD

4.055

Water Solubility, LogSw

-4.60

Polar Surface Area

15.493

Acid Dissociation Constant (pKa)

25.52

Base Dissociation Constant (pKb)

8.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.90

5276-0948 in Drug Discovery

Included in Screening Libraries

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

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 5276-0948 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5276-0948?
Check Price and Availability of 5276-0948, 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 5276-0948 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5276-0948
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5276-0948
  • 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 5276-0948 available by request