K838-0055 Screening compound: N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

K838-0055 Screening compound: N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide
K838-0055 Screening compound: N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K838-0055
N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

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

K838-0055

Molecular Formula

C24H29N3O4S (C24 H29 N3 O4 S)

Compound Name

N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

IUPAC name

N-[2-(4-methylpiperidine-1-carbonyl)phenyl]-3-(pyrrolidine-1-sulfonyl)benzamide

SMILES

CC(CC1)CCN1C(c(cccc1)c1NC(c1cccc(S(N2CCCC2)(=O)=O)c1)=O)=O

InChI

InChI=1S/C24H29N3O4S/c1-18-11-15-26(16-12-18)24(29)21-9-2-3-10-22(21)25-23(28)19-7-6-8-20(17-19)32(30,31)27-13-4-5-14-27/h2-3,6-10,17-18H,4-5,11-16H2,1H3,(H,25,28)

InChI Key

WOXPEAPQNDBGTJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04422215

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

455.58

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.393

Distribution Coefficient, logD

3.196

Water Solubility, LogSw

-3.91

Polar Surface Area

71.357

Acid Dissociation Constant (pKa)

7.64

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

41.70

K838-0055 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with K838-0055 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K838-0055?
Check Price and Availability of K838-0055, 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 K838-0055 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K838-0055
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K838-0055
  • 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 K838-0055 available by request