C697-0315 Screening compound: 1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(2-ethylphenyl)piperidine-3-carboxamide

C697-0315 Screening compound: 1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(2-ethylphenyl)piperidine-3-carboxamide
C697-0315 Screening compound: 1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(2-ethylphenyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C697-0315
1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)-N-(2-ethylphenyl)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

C697-0315

Molecular Formula

C22H30N4O4S (C22 H30 N4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

CCc(cccc1)c1NC(C(CCC1)CN1S(c1c(/C=C/N(C)C)onc1C)(=O)=O)=O

InChI

InChI=1S/C22H30N4O4S/c1-5-17-9-6-7-11-19(17)23-22(27)18-10-8-13-26(15-18)31(28,29)21-16(2)24-30-20(21)12-14-25(3)4/h6-7,9,11-12,14,18H,5,8,10,13,15H2,1-4H3,(H,23,27)/t18-/m0/s1

InChI Key

COFAIRKLYGAFQP-SFHVURJKSA-N

MDL Number (MFCD)

MFCD14783918

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

446.57

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.859

Distribution Coefficient, logD

1.858

Water Solubility, LogSw

-2.41

Polar Surface Area

79.562

Acid Dissociation Constant (pKa)

11.66

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.50

C697-0315 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C697-0315 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C697-0315?
Check Price and Availability of C697-0315, 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 C697-0315 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C697-0315
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C697-0315
  • 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 C697-0315 available by request