![CAS 1022915-33-8 [1,4]Oxazepan-6-ol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1022915-33-8.gif)
CAS RN: 1022915-33-8
[1,4]Oxazepan-6-ol
Product Availability
Choose a grade to view its available package options.
5 package records4 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250531 | 100mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20250911 | 1g | In stock | Shenzhen | Inquiry | |
| Batchno.20250413 | 250mg | In stock | Shanghai, Tianjin, Chengdu | Inquiry | |
| Batchno.20250715 | 50mg | In stock | Shanghai, Tianjin | Inquiry | |
| Batchno.20260211 | 50mg / 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: SSC-003554
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: ≥95%
- 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 | ≥95% | 0 Out of Stock | Beijing | Inquiry |
1022915-33-8 / (6R)-1,4-oxazepan-6-ol
1,4-oxazepan-6-ol | [1,4]Oxazepan-6-ol | MFCD22201128
Basic Information
CAS
1022915-33-8
Multi CAS
Yes
Molecular Formula
C5H11NO2
Molecular Weight
117.150000
Exact Mass
117.078979
SMILES
C1COC[C@@H](CN1)O
InChI
InChI=1S/C5H11NO2/c7-5-3-6-1-2-8-4-5/h5-7H,1-4H2/t5-/m1/s1
InChIKey
AJQUDIYIICBQDR-RXMQYKEDSA-N
Synonyms
1,4-oxazepan-6-ol
[1,4]Oxazepan-6-ol
MFCD22201128
(R)-[1,4]Oxazepan-6-ol
SCHEMBL10051752
Computed Properties
Structural Parameters
Heavy atom count
8
Fraction Csp3
1
H-bond acceptors
3
H-bond donors
2
Molar refractivity
29.7
TPSA
41.49
LogP / Solubility
WLOGP
-1.03
MLOGP
-0.92
XLogP3
-1.2
Consensus LogP
-1.05
Log S (ESOL)
0.08
Class (ESOL)
Highly soluble
Log S (Ali)
0.23
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.44
Class (SILICOS-IT)
Highly soluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.17
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
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