L977-1045 Screening compound: 2-(3,4-dimethylphenyl)-N-(3-methylbutyl)-3-oxo-2H,3H,5H-pyrazolo[4,3-c]quinoline-8-carboxamide

L977-1045 Screening compound: 2-(3,4-dimethylphenyl)-N-(3-methylbutyl)-3-oxo-2H,3H,5H-pyrazolo[4,3-c]quinoline-8-carboxamide
L977-1045 Screening compound: 2-(3,4-dimethylphenyl)-N-(3-methylbutyl)-3-oxo-2H,3H,5H-pyrazolo[4,3-c]quinoline-8-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L977-1045
2-(3,4-dimethylphenyl)-N-(3-methylbutyl)-3-oxo-2H,3H,5H-pyrazolo[4,3-c]quinoline-8-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

L977-1045

Molecular Formula

C24H26N4O2 (C24 H26 N4 O2)

Compound Name

2-(3,4-dimethylphenyl)-N-(3-methylbutyl)-3-oxo-2H,3H,5H-pyrazolo[4,3-c]quinoline-8-carboxamide

IUPAC name

2-(34-dimethylphenyl)-N-(3-methylbutyl)-3-oxo-2H3H5H-pyrazolo[43-c]quinoline-8-carboxamide

SMILES

CC(C)CCNC(c(cc1)cc(C2=NN3c4cc(C)c(C)cc4)c1NC=C2C3=O)=O

InChI

InChI=1S/C24H26N4O2/c1-14(2)9-10-25-23(29)17-6-8-21-19(12-17)22-20(13-26-21)24(30)28(27-22)18-7-5-15(3)16(4)11-18/h5-8,11-14,26H,9-10H2,1-4H3,(H,25,29)

InChI Key

YGRFQMHDEGPYCU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27490879

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

402.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.159

Distribution Coefficient, logD

4.060

Water Solubility, LogSw

-4.20

Polar Surface Area

61.406

Acid Dissociation Constant (pKa)

9.04

Base Dissociation Constant (pKb)

-3.32

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

L977-1045 in Drug Discovery

Included in Screening Libraries

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

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with L977-1045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L977-1045?
Check Price and Availability of L977-1045, 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 L977-1045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L977-1045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L977-1045
  • 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 L977-1045 available by request