CAS RN: 1823866-20-1
(1-Tetrahydro-2h-pyran-2-yl-1h-pyrazol-5-yl)methanol
- Product code: SSC-083916
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 | Hong Kong | Inquiry |
1823866-20-1 / [2-(oxan-2-yl)pyrazol-3-yl]methanol
Basic Information
CAS
1823866-20-1
Multi CAS
No
Molecular Formula
C9H14N2O2
Molecular Weight
182.220000
Exact Mass
182.105528
SMILES
C1CCOC(C1)N2C(=CC=N2)CO
InChI
InChI=1S/C9H14N2O2/c12-7-8-4-5-10-11(8)9-3-1-2-6-13-9/h4-5,9,12H,1-3,6-7H2
InChIKey
NFFOXSJCFKDEPJ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
13
Aromatic heavy atom count
5
Fraction Csp3
0.67
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
46.99
TPSA
47.28
LogP / Solubility
WLOGP
1.07
MLOGP
0.94
XLogP3
0.1
Consensus LogP
0.7
Log S (ESOL)
-1.8
Class (ESOL)
Soluble
Log S (Ali)
-1.83
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.98
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
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)
-3.07
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
-
4-METHOXYSPIRO[CYCLOPROPANE-1,3-INDOLINE]
- CAS RN: 1823868-84-3
- Product Code: starshine_CAS1823868-84-3
- Purity/Analytical method: >99.0%
-
4-Bromo-5,6-dihydro-pyrrolo[3,4-b]pyridin-7-one
- CAS RN: 1823870-64-9
- Product Code: SSC-083924
-
6-Iodo-5-methyl-imidazo[1,2-a]pyridine
- CAS RN: 1823870-96-7
- Product Code: starshine_CAS1823870-96-7
- Purity/Analytical method: >99.0%
-
-
5-Fluoroazepan-4-One Hydrochloride(WX601136)
- CAS RN: 1823872-70-3
- Product Code: starshine_CAS1823872-70-3
- Purity/Analytical method: >99.0%
![CAS 1823868-84-3 4-METHOXYSPIRO[CYCLOPROPANE-1,3-INDOLINE] molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823868-84-3.gif)
![CAS 1823870-64-9 4-Bromo-5,6-dihydro-pyrrolo[3,4-b]pyridin-7-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823870-64-9.gif)
![CAS 1823870-96-7 6-Iodo-5-methyl-imidazo[1,2-a]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB62738671.gif)
![CAS 1823872-34-9 1-Oxaspiro[3.3]heptan-3-one molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1823872-34-9.gif)
