K906-4529 Screening compound: 1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxylic acid

K906-4529 Screening compound: 1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxylic acid
K906-4529 Screening compound: 1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-4529
1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxylic acid

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

K906-4529

Molecular Formula

C14H21N3O5S (C14 H21 N3 O5 S)

Compound Name

1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-4-carboxylic acid

IUPAC name

1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-4-carboxylic acid

SMILES

Cc1noc(/C=C/N(C)C)c1S(N(CC1)CCC1C(O)=O)(=O)=O

InChI

InChI=1S/C14H21N3O5S/c1-10-13(12(22-15-10)6-7-16(2)3)23(20,21)17-8-4-11(5-9-17)14(18)19/h6-7,11H,4-5,8-9H2,1-3H3,(H,18,19)

InChI Key

WBBBQIISBCADLP-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

343.4

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

-0.679

Distribution Coefficient, logD

-3.240

Water Solubility, LogSw

-1.15

Polar Surface Area

85.643

Acid Dissociation Constant (pKa)

4.84

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

57.10

References: we are preparing a list of scientific research reports with K906-4529 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-4529?
Check Price and Availability of K906-4529, 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 K906-4529 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-4529
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-4529
  • 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 K906-4529 available by request