0149-0024 Screening compound: 1,3-bis[(3-methyl-1H-pyrazol-1-yl)methyl]imidazolidine-2-thione

0149-0024 Screening compound: 1,3-bis[(3-methyl-1H-pyrazol-1-yl)methyl]imidazolidine-2-thione
0149-0024 Screening compound: 1,3-bis[(3-methyl-1H-pyrazol-1-yl)methyl]imidazolidine-2-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 0149-0024
1,3-bis[(3-methyl-1H-pyrazol-1-yl)methyl]imidazolidine-2-thione

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

0149-0024

Molecular Formula

C13H18N6S (C13 H18 N6 S)

Compound Name

1,3-bis[(3-methyl-1H-pyrazol-1-yl)methyl]imidazolidine-2-thione

IUPAC name

13-bis[(3-methyl-1H-pyrazol-1-yl)methyl]imidazolidine-2-thione

SMILES

Cc1nn(CN(CCN2Cn3nc(C)cc3)C2=S)cc1

InChI

InChI=1S/C13H18N6S/c1-11-3-5-18(14-11)9-16-7-8-17(13(16)20)10-19-6-4-12(2)15-19/h3-6H,7-10H2,1-2H3

InChI Key

PGUYFJWNVPDKPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00428283

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

290.39

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

0.527

Distribution Coefficient, logD

0.527

Water Solubility, LogSw

-1.11

Polar Surface Area

39.079

Acid Dissociation Constant (pKa)

31.86

Base Dissociation Constant (pKb)

2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

46.20

0149-0024 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0149-0024 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0149-0024?
Check Price and Availability of 0149-0024, 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 0149-0024 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0149-0024
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0149-0024
  • 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 0149-0024 available by request