L805-0010 Screening compound: N-[2-(CYCLOHEX-1-EN-1-YL)ETHYL]-4-[6-OXO-3-(PYRROLIDIN-1-YL)-1,6-DIHYDROPYRIDAZIN-1-YL]BENZAMIDE

L805-0010 Screening compound: N-[2-(CYCLOHEX-1-EN-1-YL)ETHYL]-4-[6-OXO-3-(PYRROLIDIN-1-YL)-1,6-DIHYDROPYRIDAZIN-1-YL]BENZAMIDE
L805-0010 Screening compound: N-[2-(CYCLOHEX-1-EN-1-YL)ETHYL]-4-[6-OXO-3-(PYRROLIDIN-1-YL)-1,6-DIHYDROPYRIDAZIN-1-YL]BENZAMIDE alternative view

Chemical Structure Depiction of ChemDiv screening compound L805-0010
N-[2-(CYCLOHEX-1-EN-1-YL)ETHYL]-4-[6-OXO-3-(PYRROLIDIN-1-YL)-1,6-DIHYDROPYRIDAZIN-1-YL]BENZAMIDE

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

L805-0010

Molecular Formula

C23H28N4O2 (C23 H28 N4 O2)

Compound Name

N-[2-(CYCLOHEX-1-EN-1-YL)ETHYL]-4-[6-OXO-3-(PYRROLIDIN-1-YL)-1,6-DIHYDROPYRIDAZIN-1-YL]BENZAMIDE

IUPAC name

N-[2-(cyclohex-1-en-1-yl)ethyl]-4-[6-oxo-3-(pyrrolidin-1-yl)-16-dihydropyridazin-1-yl]benzamide

SMILES

O=C(c(cc1)ccc1N(C(C=C1)=O)N=C1N1CCCC1)NCCC1=CCCCC1

InChI

InChI=1S/C23H28N4O2/c28-22-13-12-21(26-16-4-5-17-26)25-27(22)20-10-8-19(9-11-20)23(29)24-15-14-18-6-2-1-3-7-18/h6,8-13H,1-5,7,14-17H2,(H,24,29)

InChI Key

QZMNULWITYKPRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27476211

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.5

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.993

Distribution Coefficient, logD

2.993

Water Solubility, LogSw

-3.42

Polar Surface Area

55.518

Acid Dissociation Constant (pKa)

13.54

Base Dissociation Constant (pKb)

6.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

43.50

L805-0010 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L805-0010 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L805-0010?
Check Price and Availability of L805-0010, 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 L805-0010 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L805-0010
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L805-0010
  • 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 L805-0010 available by request