8005-8197 Screening compound: 1-phenyl-4,5-dihydro-1H-pyrazol-3-amine

8005-8197 Screening compound: 1-phenyl-4,5-dihydro-1H-pyrazol-3-amine
8005-8197 Screening compound: 1-phenyl-4,5-dihydro-1H-pyrazol-3-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-8197
1-phenyl-4,5-dihydro-1H-pyrazol-3-amine

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

8005-8197

Molecular Formula

C9H11N3 (C9 H11 N3)

Compound Name

1-phenyl-4,5-dihydro-1H-pyrazol-3-amine

IUPAC name

1-phenyl-45-dihydro-1H-pyrazol-3-amine

SMILES

NC(CC1)=NN1c1ccccc1

InChI

InChI=1S/C9H11N3/c10-9-6-7-12(11-9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H2,10,11)

InChI Key

QENUTIJJGGTTPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00051730

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

161.21

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.383

Distribution Coefficient, logD

0.586

Water Solubility, LogSw

-0.96

Polar Surface Area

36.426

Acid Dissociation Constant (pKa)

15.84

Base Dissociation Constant (pKb)

8.12

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

8005-8197 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Opportunistic Pathogens of Immunocompromised Hosts Annotated Library (1773 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8005-8197 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-8197?
Check Price and Availability of 8005-8197, 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 8005-8197 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-8197
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-8197
  • 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 8005-8197 available by request