8018-3869 Screening compound: N-[2-(cyclohexylcarbamoyl)phenyl]oxolane-2-carboxamide

8018-3869 Screening compound: N-[2-(cyclohexylcarbamoyl)phenyl]oxolane-2-carboxamide
8018-3869 Screening compound: N-[2-(cyclohexylcarbamoyl)phenyl]oxolane-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-3869
N-[2-(cyclohexylcarbamoyl)phenyl]oxolane-2-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

8018-3869

Molecular Formula

C18H24N2O3 (C18 H24 N2 O3)

Compound Name

N-[2-(cyclohexylcarbamoyl)phenyl]oxolane-2-carboxamide

IUPAC name

N-[2-(cyclohexylcarbamoyl)phenyl]oxolane-2-carboxamide

SMILES

O=C(C1OCCC1)Nc(cccc1)c1C(NC1CCCCC1)=O

InChI

InChI=1S/C18H24N2O3/c21-17(19-13-7-2-1-3-8-13)14-9-4-5-10-15(14)20-18(22)16-11-6-12-23-16/h4-5,9-10,13,16H,1-3,6-8,11-12H2,(H,19,21)(H,20,22)/t16-/m0/s1

InChI Key

JMFQIGHQFLQFMQ-INIZCTEOSA-N

MDL Number (MFCD)

MFCD07152342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

316.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.680

Distribution Coefficient, logD

2.679

Water Solubility, LogSw

-3.34

Polar Surface Area

55.182

Acid Dissociation Constant (pKa)

9.95

Base Dissociation Constant (pKb)

-1.38

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

55.56

8018-3869 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with 8018-3869 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-3869?
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What is the minimum amount of 8018-3869 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-3869
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-3869
  • 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 8018-3869 available by request