[email protected]
CAS 7597-73-1 N-(1-bromo-2-naphthyl)acetamide molecular structure lightbox
CAS RN: 7597-73-1

N-(1-bromo-2-naphthyl)acetamide

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250807 1g / 5g Out of stock 15 business days Inquiry
  • Product code: starshine_CAS7597-73-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

7597-73-1 / N-(1-bromonaphthalen-2-yl)acetamide

Standard CAS: 7597-73-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
7597-73-1
Multi CAS
Yes
Molecular Formula
BC12H10ORn
Molecular Weight
264.120000
Exact Mass
262.994580
InChI
InChI=1S/C12H10BrNO/c1-8(15)14-11-7-6-9-4-2-3-5-10(9)12(11)13/h2-7H,1H3,(H,14,15)
InChIKey
ANOJTMSMKHYLBB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
10
Fraction Csp3
0.08
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
1
Molar refractivity
65.95
TPSA
29.1

LogP / Solubility

WLOGP
3.56
MLOGP
3.14
XLogP3
3
Consensus LogP
3.23
Log S (ESOL)
-4.15
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.3
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.45
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.8

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us