L230-0847 Screening compound: 1-(1-{[1-methyl-5-(4-methylpiperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)azepane

L230-0847 Screening compound: 1-(1-{[1-methyl-5-(4-methylpiperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)azepane
L230-0847 Screening compound: 1-(1-{[1-methyl-5-(4-methylpiperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound L230-0847
1-(1-{[1-methyl-5-(4-methylpiperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)azepane

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

L230-0847

Molecular Formula

C24H38N4O4S (C24 H38 N4 O4 S)

Compound Name

1-(1-{[1-methyl-5-(4-methylpiperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)azepane

IUPAC name

1-(1-{[1-methyl-5-(4-methylpiperidine-1-carbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carbonyl)azepane

SMILES

CC(CC1)CCN1C(c1cc(S(N(CC2)CCC2C(N2CCCCCC2)=O)(=O)=O)cn1C)=O

InChI

InChI=1S/C24H38N4O4S/c1-19-7-13-27(14-8-19)24(30)22-17-21(18-25(22)2)33(31,32)28-15-9-20(10-16-28)23(29)26-11-5-3-4-6-12-26/h17-20H,3-16H2,1-2H3

InChI Key

KIUAGIDGBFDJDI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27237115

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

478.66

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.455

Distribution Coefficient, logD

2.455

Water Solubility, LogSw

-2.55

Polar Surface Area

67.887

Acid Dissociation Constant (pKa)

23.63

Base Dissociation Constant (pKb)

1.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

75.00

L230-0847 in Drug Discovery

Included in Screening Libraries

Macl-GPIb alpha Interaction Library (22969 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with L230-0847 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L230-0847?
Check Price and Availability of L230-0847, 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 L230-0847 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L230-0847
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L230-0847
  • 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 L230-0847 available by request