8018-5187 Screening compound: 22-methyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0~2,7~.0~15,20~]pentacosa-2(7),3,5,15(20),16,18-hexaen-23-ol

8018-5187 Screening compound: 22-methyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0~2,7~.0~15,20~]pentacosa-2(7),3,5,15(20),16,18-hexaen-23-ol
8018-5187 Screening compound: 22-methyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0~2,7~.0~15,20~]pentacosa-2(7),3,5,15(20),16,18-hexaen-23-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-5187
22-methyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0~2,7~.0~15,20~]pentacosa-2(7),3,5,15(20),16,18-hexaen-23-ol

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

8018-5187

Molecular Formula

C22H27NO4 (C22 H27 NO4)

Compound Name

22-methyl-8,11,14-trioxa-25-azatetracyclo[19.3.1.0~2,7~.0~15,20~]pentacosa-2(7),3,5,15(20),16,18-hexaen-23-ol

IUPAC name

22-methyl-81114-trioxa-25-azatetracyclo[19.3.1.0^{27}.0^{1520}]pentacosa-2(7)3515(20)1618-hexaen-23-ol

SMILES

CC(C(C1)O)C2NC1c(cccc1)c1OCCOCCOc1c2cccc1

InChI

InChI=1S/C22H27NO4/c1-15-19(24)14-18-16-6-2-4-8-20(16)26-12-10-25-11-13-27-21-9-5-3-7-17(21)22(15)23-18/h2-9,15,18-19,22-24H,10-14H2,1H3

InChI Key

RIQORZMWFMJBJT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07800288

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

369.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.201

Distribution Coefficient, logD

0.021

Water Solubility, LogSw

-3.23

Polar Surface Area

52.379

Acid Dissociation Constant (pKa)

18.88

Base Dissociation Constant (pKb)

10.58

Number of Chiral Centers

4.00

Percent sp3 carbon bonding

45.50

8018-5187 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 8018-5187 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-5187?
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What is the minimum amount of 8018-5187 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-5187
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-5187
  • 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 8018-5187 available by request