F061-1335 Screening compound: 1-[1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carbonyl]azepane

F061-1335 Screening compound: 1-[1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carbonyl]azepane
F061-1335 Screening compound: 1-[1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carbonyl]azepane alternative view

Chemical Structure Depiction of ChemDiv screening compound F061-1335
1-[1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-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

F061-1335

Molecular Formula

C26H35N3O4S (C26 H35 N3 O4 S)

Compound Name

1-[1-({5-[(1E)-2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carbonyl]azepane

IUPAC name

1-[1-({5-[(1E)-2-(25-dimethylphenyl)ethenyl]-3-methyl-12-oxazol-4-yl}sulfonyl)piperidine-3-carbonyl]azepane

SMILES

Cc1noc(/C=C/c2c(C)ccc(C)c2)c1S(N(CCC1)CC1C(N1CCCCCC1)=O)(=O)=O

InChI

InChI=1S/C26H35N3O4S/c1-19-10-11-20(2)22(17-19)12-13-24-25(21(3)27-33-24)34(31,32)29-16-8-9-23(18-29)26(30)28-14-6-4-5-7-15-28/h10-13,17,23H,4-9,14-16,18H2,1-3H3/t23-/m0/s1

InChI Key

PGVNEKSISQIAJG-QHCPKHFHSA-N

MDL Number (MFCD)

MFCD14938738

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

485.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.360

Distribution Coefficient, logD

4.360

Water Solubility, LogSw

-4.27

Polar Surface Area

70.378

Acid Dissociation Constant (pKa)

22.98

Base Dissociation Constant (pKb)

4.72

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

53.80

References: we are preparing a list of scientific research reports with F061-1335 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F061-1335?
Check Price and Availability of F061-1335, 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 F061-1335 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F061-1335
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F061-1335
  • 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 F061-1335 available by request