CAS RN: 6341-40-8
N-(1-Naphtyl)-N-phenylnitrosamine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250417 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS6341-40-8
- Purity/Analytical Methods: >99.0%
6341-40-8 / N-naphthalen-1-yl-N-phenylnitrous amide
Basic Information
CAS
6341-40-8
Multi CAS
Yes
Molecular Formula
C16H12N2O
Molecular Weight
248.280000
Exact Mass
248.094963
InChI
InChI=1S/C16H12N2O/c19-17-18(14-9-2-1-3-10-14)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H
InChIKey
GCFKVRLYIXPTIN-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
16
Rotatable bonds
3
H-bond acceptors
2
Molar refractivity
78.32
TPSA
32.67
LogP / Solubility
WLOGP
4.66
MLOGP
4.11
XLogP3
4.7
Consensus LogP
4.49
Log S (ESOL)
-4.74
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.96
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.5
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.93
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
