N060-0118 Screening compound: 11-ETHYL-6-METHOXY-13-METHYL-11-AZAHEXACYCLO[7.7.2.1^(2,5).0^(1,10).0^(3,8).0^(13,17)]NONADECANE-4,8,16-TRIOL

N060-0118 Screening compound: 11-ETHYL-6-METHOXY-13-METHYL-11-AZAHEXACYCLO[7.7.2.1^(2,5).0^(1,10).0^(3,8).0^(13,17)]NONADECANE-4,8,16-TRIOL
N060-0118 Screening compound: 11-ETHYL-6-METHOXY-13-METHYL-11-AZAHEXACYCLO[7.7.2.1^(2,5).0^(1,10).0^(3,8).0^(13,17)]NONADECANE-4,8,16-TRIOL alternative view

Chemical Structure Depiction of ChemDiv screening compound N060-0118
11-ETHYL-6-METHOXY-13-METHYL-11-AZAHEXACYCLO[7.7.2.1^(2,5).0^(1,10).0^(3,8).0^(13,17)]NONADECANE-4,8,16-TRIOL

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

N060-0118

Molecular Formula

C22H35NO4 (C22 H35 NO4)

Compound Name

11-ETHYL-6-METHOXY-13-METHYL-11-AZAHEXACYCLO[7.7.2.1^(2,5).0^(1,10).0^(3,8).0^(13,17)]NONADECANE-4,8,16-TRIOL

IUPAC name

(1S4S5S6S8S9S10R13R16S)-11-ethyl-6-methoxy-13-methyl-11-azahexacyclo[7.7.2.1^{25}.0^{110}.0^{38}.0^{1317}]nonadecane-4816-triol

SMILES

CCN(C[C@](C)(CC1)C2C[C@@H]3[C@@](C[C@@H]([C@H]4CC56)OC)(C6[C@H]4O)O)[C@H]3[C@]25[C@H]1O

InChI

InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12?,13+,14+,15?,16+,17?,18+,19+,20+,21+,22-/m1/s1

InChI Key

HKQZUYOVMYOFIT-PHSWLHCFSA-N

MDL Number (MFCD)

MFCD02657261

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

377.52

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.261

Distribution Coefficient, logD

-0.210

Water Solubility, LogSw

-2.44

Polar Surface Area

56.552

Acid Dissociation Constant (pKa)

15.27

Base Dissociation Constant (pKb)

8.86

Number of Chiral Centers

12.00

Percent sp3 carbon bonding

100.00

N060-0118 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Natural Compounds Library (353 compounds)

Recognition Elements PPI Library (24135 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with N060-0118 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound N060-0118?
Check Price and Availability of N060-0118, 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 N060-0118 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for N060-0118
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for N060-0118
  • 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 N060-0118 available by request