G532-0055 Screening compound: 1-(adamantan-1-yl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]urea

G532-0055 Screening compound: 1-(adamantan-1-yl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]urea
G532-0055 Screening compound: 1-(adamantan-1-yl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]urea alternative view

Chemical Structure Depiction of ChemDiv screening compound G532-0055
1-(adamantan-1-yl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-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

G532-0055

Molecular Formula

C18H28N4O (C18 H28 N4 O)

Compound Name

1-(adamantan-1-yl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]urea

IUPAC name

1-(adamantan-1-yl)-3-[(135-trimethyl-1H-pyrazol-4-yl)methyl]urea

SMILES

Cc1c(CNC(NC2(CC(C3)C4)CC4CC3C2)=O)c(C)nn1C

InChI

InChI=1S/C18H28N4O/c1-11-16(12(2)22(3)21-11)10-19-17(23)20-18-7-13-4-14(8-18)6-15(5-13)9-18/h13-15H,4-10H2,1-3H3,(H2,19,20,23)

InChI Key

WUPRSBPKJIUYML-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06156751

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.45

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.374

Distribution Coefficient, logD

2.374

Water Solubility, LogSw

-2.64

Polar Surface Area

49.721

Acid Dissociation Constant (pKa)

15.69

Base Dissociation Constant (pKb)

5.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

77.80

References: we are preparing a list of scientific research reports with G532-0055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G532-0055?
Check Price and Availability of G532-0055, 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 G532-0055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G532-0055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G532-0055
  • 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 G532-0055 available by request