CAS RN: 104484-71-1
Sodium 3-(1-Naphthylamino)propanesulfonate
Product Availability
Choose a grade to view its available package options.
6 package records5 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250108 | 100g | Out of stock | Inquiry | |
| Batchno.20250227 | 1g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20260506 | 1g / 5g / 25g | Confirm by inquiry | Shanghai, Shandong | Inquiry |
| Batchno.20250121 | 250mg | In stock | Shanghai, Tianjin | Inquiry |
| Batchno.20260509 | 25g | In stock | Tianjin, Wuhan, Chengdu | Inquiry |
| Batchno.20250929 | 5g | In stock | Shanghai, Tianjin, Wuhan, Chengdu | Inquiry |
- Product code: SSC-006294
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 5g
- Available purity: ＞97%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 5g | ＞97% | 0 Out of Stock | Hong Kong | Inquiry |
104484-71-1 / sodium 3-(naphthalen-1-ylamino)propane-1-sulfonate
DTXSID10635463 | Sodium 3-[(naphthalen-1-yl)amino]propane-1-sulfonate | Sodium 3-((naphthalen-1-yl)amino)propane-1-sulfonate
Basic Information
CAS
104484-71-1
Multi CAS
Yes
Molecular Formula
C13H14NNaO3S
Molecular Weight
287.310000
Exact Mass
287.059209
SMILES
C1=CC=C2C(=C1)C=CC=C2NCCCS(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C13H15NO3S.Na/c15-18(16,17)10-4-9-14-13-8-3-6-11-5-1-2-7-12(11)13;/h1-3,5-8,14H,4,9-10H2,(H,15,16,17);/q;+1/p-1
InChIKey
HSOPFPPLFWZKJN-UHFFFAOYSA-M
Synonyms
DTXSID10635463
Sodium 3-[(naphthalen-1-yl)amino]propane-1-sulfonate
Sodium 3-((naphthalen-1-yl)amino)propane-1-sulfonate
RefChem:1098672
DTXCID60586214
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
10
Fraction Csp3
0.23
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
1
Molar refractivity
71.62
TPSA
69.23
LogP / Solubility
WLOGP
-0.81
MLOGP
-0.7
XLogP3
-0.81
Consensus LogP
-0.77
Log S (ESOL)
-1.17
Class (ESOL)
Soluble
Log S (Ali)
-1.33
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.46
Class (SILICOS-IT)
Soluble
ADME
GI absorption
Low
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.05
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5
