![CAS 1894191-97-9 Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-amine, N,N-dipropyl-, (11bR)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1894191-97-9.gif)
CAS RN: 1894191-97-9
Dinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepin-4-amine, N,N-dipropyl-, (11bR)-
Product Availability
Choose a grade to view its available package options.
5 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260221 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260226 | 100mg / 250mg / 1g | Out of stock | 8-10 business days | Inquiry | |
| Batchno.20250403 | 1g | In stock | Shenzhen | Inquiry | |
| Batchno.20250323 | 250mg | In stock | Shanghai, Shenzhen, Tianjin, Chengdu | Inquiry | |
| Batchno.20260109 | 5g | Out of stock | Inquiry |
- Product code: SSC-088554
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: 1g
- Available purity: ≥98%
- 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 |
|---|---|---|---|---|
| 1g | ≥98% | 0 Out of Stock | Shenzhen | Inquiry |
1894191-97-9 / N,N-dipropyl-12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-amine
Basic Information
CAS
1894191-97-9
Multi CAS
No
Molecular Formula
C26H26NO2P
Molecular Weight
415.500000
Exact Mass
415.170116
SMILES
CCCN(CCC)P1OC2=C(C3=CC=CC=C3C=C2)C4=C(O1)C=CC5=CC=CC=C54
InChI
InChI=1S/C26H26NO2P/c1-3-17-27(18-4-2)30-28-23-15-13-19-9-5-7-11-21(19)25(23)26-22-12-8-6-10-20(22)14-16-24(26)29-30/h5-16H,3-4,17-18H2,1-2H3
InChIKey
MLHMEHOYQRTGQZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
30
Aromatic heavy atom count
23
Fraction Csp3
0.23
Rotatable bonds
5
H-bond acceptors
3
Molar refractivity
129.87
TPSA
29.52
LogP / Solubility
WLOGP
8.35
MLOGP
7.38
XLogP3
7.9
Consensus LogP
7.88
Log S (ESOL)
-7.92
Class (ESOL)
Insoluble
Log S (Ali)
-9
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.89
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
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
0.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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