L461-0424 Screening compound: N-(3-acetylphenyl)-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepan-1-yl)butanamide

L461-0424 Screening compound: N-(3-acetylphenyl)-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepan-1-yl)butanamide
L461-0424 Screening compound: N-(3-acetylphenyl)-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepan-1-yl)butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L461-0424
N-(3-acetylphenyl)-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepan-1-yl)butanamide

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

L461-0424

Molecular Formula

C23H25N5O3S (C23 H25 N5 O3 S)

Compound Name

N-(3-acetylphenyl)-4-oxo-4-(4-{[1,3]thiazolo[5,4-b]pyridin-2-yl}-1,4-diazepan-1-yl)butanamide

IUPAC name

N-(3-acetylphenyl)-4-oxo-4-(4-{[13]thiazolo[54-b]pyridin-2-yl}-14-diazepan-1-yl)butanamide

SMILES

CC(c1cccc(NC(CCC(N(CCC2)CCN2c2nc3cccnc3s2)=O)=O)c1)=O

InChI

InChI=1S/C23H25N5O3S/c1-16(29)17-5-2-6-18(15-17)25-20(30)8-9-21(31)27-11-4-12-28(14-13-27)23-26-19-7-3-10-24-22(19)32-23/h2-3,5-7,10,15H,4,8-9,11-14H2,1H3,(H,25,30)

InChI Key

CZGFCAOXCXBQJG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27254178

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.55

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.207

Distribution Coefficient, logD

2.203

Water Solubility, LogSw

-2.86

Polar Surface Area

75.868

Acid Dissociation Constant (pKa)

10.73

Base Dissociation Constant (pKb)

5.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

L461-0424 in Drug Discovery

Included in Screening Libraries

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 L461-0424 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L461-0424?
Check Price and Availability of L461-0424, 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 L461-0424 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L461-0424
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L461-0424
  • 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 L461-0424 available by request