G774-0219 Screening compound: 1-{1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]piperidine-4-carbonyl}azepane

G774-0219 Screening compound: 1-{1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]piperidine-4-carbonyl}azepane
G774-0219 Screening compound: 1-{1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]piperidine-4-carbonyl}azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound G774-0219
1-{1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]piperidine-4-carbonyl}azepane

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

G774-0219

Molecular Formula

C28H37N5O (C28 H37 N5 O)

Compound Name

1-{1-[4-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]piperidine-4-carbonyl}azepane

IUPAC name

1-{1-[4-(25-dimethyl-1H-pyrrol-1-yl)-3-methyl-1-phenyl-1H-pyrazol-5-yl]piperidine-4-carbonyl}azepane

SMILES

Cc1ccc(C)n1-c(c(C)nn1-c2ccccc2)c1N(CC1)CCC1C(N1CCCCCC1)=O

InChI

InChI=1S/C28H37N5O/c1-21-13-14-22(2)32(21)26-23(3)29-33(25-11-7-6-8-12-25)27(26)30-19-15-24(16-20-30)28(34)31-17-9-4-5-10-18-31/h6-8,11-14,24H,4-5,9-10,15-20H2,1-3H3

InChI Key

AZPTYSWWNGNSBZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15035137

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

459.63

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.702

Distribution Coefficient, logD

4.702

Water Solubility, LogSw

-4.30

Polar Surface Area

36.181

Acid Dissociation Constant (pKa)

23.23

Base Dissociation Constant (pKb)

3.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

G774-0219 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with G774-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G774-0219?
Check Price and Availability of G774-0219, 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 G774-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G774-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G774-0219
  • 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 G774-0219 available by request