L299-1633 Screening compound: 3-[3-(azepane-1-sulfonyl)-4-methoxyphenyl]-2-methyl-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione

L299-1633 Screening compound: 3-[3-(azepane-1-sulfonyl)-4-methoxyphenyl]-2-methyl-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione
L299-1633 Screening compound: 3-[3-(azepane-1-sulfonyl)-4-methoxyphenyl]-2-methyl-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound L299-1633
3-[3-(azepane-1-sulfonyl)-4-methoxyphenyl]-2-methyl-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione

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

L299-1633

Molecular Formula

C21H26N4O5S (C21 H26 N4 O5 S)

Compound Name

3-[3-(azepane-1-sulfonyl)-4-methoxyphenyl]-2-methyl-4H,5H,6H,7H,8H-pyrazolo[1,5-a][1,3]diazepine-5,8-dione

IUPAC name

3-[3-(azepane-1-sulfonyl)-4-methoxyphenyl]-2-methyl-4H5H6H7H8H-pyrazolo[15-a][13]diazepine-58-dione

SMILES

Cc(c(-c(cc1)cc(S(N2CCCCCC2)(=O)=O)c1OC)c1NC(CC2)=O)nn1C2=O

InChI

InChI=1S/C21H26N4O5S/c1-14-20(21-22-18(26)9-10-19(27)25(21)23-14)15-7-8-16(30-2)17(13-15)31(28,29)24-11-5-3-4-6-12-24/h7-8,13H,3-6,9-12H2,1-2H3,(H,22,26)

InChI Key

BQUKBHGMOSCLRK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27242388

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.235

Distribution Coefficient, logD

0.950

Water Solubility, LogSw

-2.42

Polar Surface Area

92.086

Acid Dissociation Constant (pKa)

7.43

Base Dissociation Constant (pKb)

-2.44

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

47.60

L299-1633 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with L299-1633 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L299-1633?
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What is the minimum amount of L299-1633 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L299-1633
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L299-1633
  • 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 L299-1633 available by request