[email protected]
CAS 1363166-31-7 5-BroMo-2-naphthyl 2-(6-Methoxy-2-naphthyl)propanoate molecular structure lightbox
CAS RN: 1363166-31-7

5-BroMo-2-naphthyl 2-(6-Methoxy-2-naphthyl)propanoate

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250925 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-045236
GET A QUOTE
Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 0.1g, 0.25g
  • Available purity: >95%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1363166-31-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 2 In Stock Shanghai Inquiry
0.1g >95% 1 In Stock Hong Kong Inquiry
0.25g >95% 0 Out of Stock Hong Kong Inquiry

1363166-31-7 / (5-bromonaphthalen-2-yl) 2-(6-methoxynaphthalen-2-yl)propanoate

Standard CAS: 1363166-31-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1363166-31-7
Multi CAS
No
Molecular Formula
C24H19BrO3
Molecular Weight
435.300000
Exact Mass
434.051760
SMILES
CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OC3=CC4=C(C=C3)C(=CC=C4)Br
InChI
InChI=1S/C24H19BrO3/c1-15(16-6-7-18-13-20(27-2)9-8-17(18)12-16)24(26)28-21-10-11-22-19(14-21)4-3-5-23(22)25/h3-15H,1-2H3
InChIKey
IEVYZTREZUZVFL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
28
Aromatic heavy atom count
20
Fraction Csp3
0.12
Rotatable bonds
4
H-bond acceptors
3
Molar refractivity
116.2
TPSA
35.53

LogP / Solubility

WLOGP
6.47
MLOGP
5.72
XLogP3
7
Consensus LogP
6.4
Log S (ESOL)
-6.88
Class (ESOL)
Insoluble
Log S (Ali)
-7.8
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.34
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-0.78

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3.5

Customers Also Viewed

Get In Touch

Contact Us