C548-3795 Screening compound: 2-(N-methyl2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-N-(3-phenylpropyl)acetamide

C548-3795 Screening compound: 2-(N-methyl2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-N-(3-phenylpropyl)acetamide
C548-3795 Screening compound: 2-(N-methyl2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-N-(3-phenylpropyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C548-3795
2-(N-methyl2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-N-(3-phenylpropyl)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

C548-3795

Molecular Formula

C21H25N3O4S (C21 H25 N3 O4 S)

Compound Name

2-(N-methyl2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonamido)-N-(3-phenylpropyl)acetamide

IUPAC name

2-(N-methyl2-oxo-1234-tetrahydroquinoline-6-sulfonamido)-N-(3-phenylpropyl)acetamide

SMILES

CN(CC(NCCCc1ccccc1)=O)S(c(cc1)cc(CC2)c1NC2=O)(=O)=O

InChI

InChI=1S/C21H25N3O4S/c1-24(15-21(26)22-13-5-8-16-6-3-2-4-7-16)29(27,28)18-10-11-19-17(14-18)9-12-20(25)23-19/h2-4,6-7,10-11,14H,5,8-9,12-13,15H2,1H3,(H,22,26)(H,23,25)

InChI Key

HTFMRIGTYOYUTN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14769812

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.51

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.213

Distribution Coefficient, logD

2.212

Water Solubility, LogSw

-3.04

Polar Surface Area

81.936

Acid Dissociation Constant (pKa)

9.90

Base Dissociation Constant (pKb)

-1.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with C548-3795 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C548-3795?
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What is the minimum amount of C548-3795 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C548-3795
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C548-3795
  • 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 C548-3795 available by request