M077-0456 Screening compound: N-[(4-butoxyphenyl)methyl]-1-{1,3-dimethyl-1H-pyrazolo[3,4-c]pyridin-7-yl}piperidine-4-carboxamide

M077-0456 Screening compound: N-[(4-butoxyphenyl)methyl]-1-{1,3-dimethyl-1H-pyrazolo[3,4-c]pyridin-7-yl}piperidine-4-carboxamide
M077-0456 Screening compound: N-[(4-butoxyphenyl)methyl]-1-{1,3-dimethyl-1H-pyrazolo[3,4-c]pyridin-7-yl}piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M077-0456
N-[(4-butoxyphenyl)methyl]-1-{1,3-dimethyl-1H-pyrazolo[3,4-c]pyridin-7-yl}piperidine-4-carboxamide

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

M077-0456

Molecular Formula

C25H33N5O2 (C25 H33 N5 O2)

Compound Name

N-[(4-butoxyphenyl)methyl]-1-{1,3-dimethyl-1H-pyrazolo[3,4-c]pyridin-7-yl}piperidine-4-carboxamide

IUPAC name

N-[(4-butoxyphenyl)methyl]-1-{13-dimethyl-1H-pyrazolo[34-c]pyridin-7-yl}piperidine-4-carboxamide

SMILES

CCCCOc1ccc(CNC(C(CC2)CCN2c2nccc3c2n(C)nc3C)=O)cc1

InChI

InChI=1S/C25H33N5O2/c1-4-5-16-32-21-8-6-19(7-9-21)17-27-25(31)20-11-14-30(15-12-20)24-23-22(10-13-26-24)18(2)28-29(23)3/h6-10,13,20H,4-5,11-12,14-17H2,1-3H3,(H,27,31)

InChI Key

JRYULYKQEDODER-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15140492

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

435.57

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.523

Distribution Coefficient, logD

2.941

Water Solubility, LogSw

-3.40

Polar Surface Area

58.621

Acid Dissociation Constant (pKa)

13.57

Base Dissociation Constant (pKb)

7.85

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

48.00

M077-0456 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with M077-0456 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M077-0456?
Check Price and Availability of M077-0456, 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 M077-0456 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M077-0456
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M077-0456
  • 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 M077-0456 available by request