G406-0136 Screening compound: N-[(3-methoxyphenyl)methyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]acetamide

G406-0136 Screening compound: N-[(3-methoxyphenyl)methyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]acetamide
G406-0136 Screening compound: N-[(3-methoxyphenyl)methyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G406-0136
N-[(3-methoxyphenyl)methyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]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

G406-0136

Molecular Formula

C23H27N3O5S (C23 H27 N3 O5 S)

Compound Name

N-[(3-methoxyphenyl)methyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1,2,3,4-tetrahydroquinolin-1-yl]acetamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-2-[2-oxo-6-(pyrrolidine-1-sulfonyl)-1234-tetrahydroquinolin-1-yl]acetamide

SMILES

COc1cccc(CNC(CN(C(CC2)=O)c(cc3)c2cc3S(N2CCCC2)(=O)=O)=O)c1

InChI

InChI=1S/C23H27N3O5S/c1-31-19-6-4-5-17(13-19)15-24-22(27)16-26-21-9-8-20(14-18(21)7-10-23(26)28)32(29,30)25-11-2-3-12-25/h4-6,8-9,13-14H,2-3,7,10-12,15-16H2,1H3,(H,24,27)

InChI Key

SRPOIXHMDJLBEW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15009741

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.755

Distribution Coefficient, logD

2.755

Water Solubility, LogSw

-3.46

Polar Surface Area

79.711

Acid Dissociation Constant (pKa)

13.50

Base Dissociation Constant (pKb)

-0.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

39.10

G406-0136 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with G406-0136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G406-0136?
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What is the minimum amount of G406-0136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G406-0136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G406-0136
  • 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 G406-0136 available by request