C697-0299 Screening compound: N-(4-chlorophenyl)-1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide

C697-0299 Screening compound: N-(4-chlorophenyl)-1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide
C697-0299 Screening compound: N-(4-chlorophenyl)-1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C697-0299
N-(4-chlorophenyl)-1-({5-[(1E)-2-(dimethylamino)ethenyl]-3-methyl-1,2-oxazol-4-yl}sulfonyl)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

C697-0299

Molecular Formula

C20H25ClN4O4S (C20 H25 ClN4 O4 S)

Compound Name

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

IUPAC name

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

SMILES

Cc1noc(/C=C/N(C)C)c1S(N(CCC1)CC1C(Nc(cc1)ccc1Cl)=O)(=O)=O

InChI

InChI=1S/C20H25ClN4O4S/c1-14-19(18(29-23-14)10-12-24(2)3)30(27,28)25-11-4-5-15(13-25)20(26)22-17-8-6-16(21)7-9-17/h6-10,12,15H,4-5,11,13H2,1-3H3,(H,22,26)/t15-/m0/s1

InChI Key

RUZCERCUQQVLLI-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14783912

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.96

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

1.656

Distribution Coefficient, logD

1.653

Water Solubility, LogSw

-2.85

Polar Surface Area

80.259

Acid Dissociation Constant (pKa)

9.66

Base Dissociation Constant (pKb)

4.57

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

C697-0299 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Aurora A-B Kinases Targeted Library (9426 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
  • Cancer
  • Digestive system
  • Male
  • Female
  • Hemic and lymphatic
Targets:
  • Others
  • Kinases
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C697-0299 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C697-0299?
Check Price and Availability of C697-0299, 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 C697-0299 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C697-0299
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C697-0299
  • 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 C697-0299 available by request