D308-0219 Screening compound: 2-({5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide

D308-0219 Screening compound: 2-({5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide
D308-0219 Screening compound: 2-({5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D308-0219
2-({5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide

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

D308-0219

Molecular Formula

C24H25N5O3S2 (C24 H25 N5 O3 S2)

Compound Name

2-({5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl}sulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide

IUPAC name

2-({59-dimethyl-[124]triazolo[43-a]quinolin-1-yl}sulfanyl)-N-[4-(pyrrolidine-1-sulfonyl)phenyl]acetamide

SMILES

Cc1cccc2c1n1c(SCC(Nc(cc3)ccc3S(N3CCCC3)(=O)=O)=O)nnc1cc2C

InChI

InChI=1S/C24H25N5O3S2/c1-16-6-5-7-20-17(2)14-21-26-27-24(29(21)23(16)20)33-15-22(30)25-18-8-10-19(11-9-18)34(31,32)28-12-3-4-13-28/h5-11,14H,3-4,12-13,15H2,1-2H3,(H,25,30)

InChI Key

NLMPSBZWFYUXMC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09982476

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

495.63

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.195

Distribution Coefficient, logD

4.195

Water Solubility, LogSw

-4.27

Polar Surface Area

76.084

Acid Dissociation Constant (pKa)

10.38

Base Dissociation Constant (pKb)

2.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with D308-0219 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D308-0219?
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What is the minimum amount of D308-0219 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D308-0219
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D308-0219
  • 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 D308-0219 available by request