4466-0187 Screening compound: 3-(butan-2-yl)-1-(5-{[(butan-2-yl)carbamoyl]amino}-1,3-dimethyl-2-oxoimidazolidin-4-yl)urea

4466-0187 Screening compound: 3-(butan-2-yl)-1-(5-{[(butan-2-yl)carbamoyl]amino}-1,3-dimethyl-2-oxoimidazolidin-4-yl)urea
4466-0187 Screening compound: 3-(butan-2-yl)-1-(5-{[(butan-2-yl)carbamoyl]amino}-1,3-dimethyl-2-oxoimidazolidin-4-yl)urea alternative view

Chemical Structure Depiction of ChemDiv screening compound 4466-0187
3-(butan-2-yl)-1-(5-{[(butan-2-yl)carbamoyl]amino}-1,3-dimethyl-2-oxoimidazolidin-4-yl)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

4466-0187

Molecular Formula

C15H30N6O3 (C15 H30 N6 O3)

Compound Name

3-(butan-2-yl)-1-(5-{[(butan-2-yl)carbamoyl]amino}-1,3-dimethyl-2-oxoimidazolidin-4-yl)urea

IUPAC name

3-(butan-2-yl)-1-(5-{[(butan-2-yl)carbamoyl]amino}-13-dimethyl-2-oxoimidazolidin-4-yl)urea

SMILES

CCC(C)NC(NC(C(NC(NC(C)CC)=O)N1C)N(C)C1=O)=O

InChI

InChI=1S/C15H30N6O3/c1-7-9(3)16-13(22)18-11-12(21(6)15(24)20(11)5)19-14(23)17-10(4)8-2/h9-12H,7-8H2,1-6H3,(H2,16,18,22)(H2,17,19,23)

InChI Key

IHHVVMAPGRZQKA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02738005

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

342.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

4.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.215

Distribution Coefficient, logD

0.215

Water Solubility, LogSw

-0.71

Polar Surface Area

85.636

Acid Dissociation Constant (pKa)

15.04

Base Dissociation Constant (pKb)

5.88

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

80.00

4466-0187 in Drug Discovery

Included in Screening Libraries

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

Dark Chemical Matter Library (18430 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
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 4466-0187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4466-0187?
Check Price and Availability of 4466-0187, 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 4466-0187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4466-0187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4466-0187
  • 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 4466-0187 available by request