F377-0045 Screening compound: N-(3,5-dimethoxyphenyl)-1-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

F377-0045 Screening compound: N-(3,5-dimethoxyphenyl)-1-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide
F377-0045 Screening compound: N-(3,5-dimethoxyphenyl)-1-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F377-0045
N-(3,5-dimethoxyphenyl)-1-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

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

F377-0045

Molecular Formula

C27H32N4O5S (C27 H32 N4 O5 S)

Compound Name

N-(3,5-dimethoxyphenyl)-1-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

IUPAC name

N-(35-dimethoxyphenyl)-1-[6-(pyrrolidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

SMILES

COc1cc(NC(C(CCC2)CN2c2ccc(cc(cc3)S(N4CCCC4)(=O)=O)c3n2)=O)cc(OC)c1

InChI

InChI=1S/C27H32N4O5S/c1-35-22-15-21(16-23(17-22)36-2)28-27(32)20-6-5-11-30(18-20)26-10-7-19-14-24(8-9-25(19)29-26)37(33,34)31-12-3-4-13-31/h7-10,14-17,20H,3-6,11-13,18H2,1-2H3,(H,28,32)/t20-/m0/s1

InChI Key

YFPYOHVOUVENRM-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27120825

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

524.64

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.050

Distribution Coefficient, logD

4.048

Water Solubility, LogSw

-4.14

Polar Surface Area

81.674

Acid Dissociation Constant (pKa)

9.91

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

F377-0045 in Drug Discovery

Included in Screening Libraries

Targeted Diversity Library (40567 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with F377-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F377-0045?
Check Price and Availability of F377-0045, 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 F377-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F377-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F377-0045
  • 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 F377-0045 available by request