F377-0554 Screening compound: N-(3-chloro-4-methoxyphenyl)-1-[6-(piperidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

F377-0554 Screening compound: N-(3-chloro-4-methoxyphenyl)-1-[6-(piperidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide
F377-0554 Screening compound: N-(3-chloro-4-methoxyphenyl)-1-[6-(piperidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F377-0554
N-(3-chloro-4-methoxyphenyl)-1-[6-(piperidine-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

F377-0554

Molecular Formula

C27H31ClN4O4S (C27 H31 ClN4 O4 S)

Compound Name

N-(3-chloro-4-methoxyphenyl)-1-[6-(piperidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

IUPAC name

N-(3-chloro-4-methoxyphenyl)-1-[6-(piperidine-1-sulfonyl)quinolin-2-yl]piperidine-3-carboxamide

SMILES

COc(ccc(NC(C(CCC1)CN1c(ccc1c2)nc1ccc2S(N1CCCCC1)(=O)=O)=O)c1)c1Cl

InChI

InChI=1S/C27H31ClN4O4S/c1-36-25-11-8-21(17-23(25)28)29-27(33)20-6-5-13-31(18-20)26-12-7-19-16-22(9-10-24(19)30-26)37(34,35)32-14-3-2-4-15-32/h7-12,16-17,20H,2-6,13-15,18H2,1H3,(H,29,33)/t20-/m0/s1

InChI Key

NZPZXPBRPGQKHU-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD27120875

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

543.09

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.752

Distribution Coefficient, logD

4.749

Water Solubility, LogSw

-5.00

Polar Surface Area

73.851

Acid Dissociation Constant (pKa)

9.67

Base Dissociation Constant (pKb)

3.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.70

F377-0554 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with F377-0554 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F377-0554?
Check Price and Availability of F377-0554, 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 F377-0554 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F377-0554
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F377-0554
  • 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 F377-0554 available by request