CAS RN: 176019-04-8
2-Piperidinecarboxylicacid,3-hydroxy-,(2R,3R)-(9CI)
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.20250404 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS176019-04-8
- Purity/Analytical Methods: >99.0%
176019-04-8 / (2R,3R)-3-hydroxypiperidine-2-carboxylic acid
Basic Information
CAS
176019-04-8
Multi CAS
No
Molecular Formula
C6H11NO3
Molecular Weight
145.160000
Exact Mass
145.073893
SMILES
C1C[C@H]([C@@H](NC1)C(=O)O)O
InChI
InChI=1S/C6H11NO3/c8-4-2-1-3-7-5(4)6(9)10/h4-5,7-8H,1-3H2,(H,9,10)/t4-,5-/m1/s1
InChIKey
FDMYUQHVJYNDLI-RFZPGFLSSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Fraction Csp3
0.83
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
34.67
TPSA
69.56
LogP / Solubility
WLOGP
-0.82
MLOGP
-0.72
XLogP3
-2.8
Consensus LogP
-1.45
Log S (ESOL)
-0.16
Class (ESOL)
Very soluble
Log S (Ali)
-0.16
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.05
Class (SILICOS-IT)
Very 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)
-4.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
![CAS 176019-19-5 Methyl (1S,2R,3R,4R,6S)-5-Oxotricyclo[2.2.1.02,6]heptane-3-carboxylate molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Methyl (1S,2R,3R,4R,6S)-5-Oxotricyclo[2.2.1.02,6]heptane-3-carboxylate
- CAS RN: 176019-19-5
- Product Code: SSC-077161
-
-
Bicyclo[3.1.0]hexane-2,6-dicarboxylic acid, 2-amino-, (1R,2R,5S,6R)-rel- (9CI)
- CAS RN: 176027-90-0
- Product Code: SSC-077164
-
-
b-AMino-4-Methoxybenzenepropanol
- CAS RN: 176035-15-7
- Product Code: starshine_CAS176035-15-7
- Purity/Analytical method: >99.0%
-
FMOC-DL-1-NAPHTHYLALANINE
- CAS RN: 176036-48-9
- Product Code: starshine_CAS176036-48-9
- Purity/Analytical method: >99.0%
![CAS 176019-19-5 Methyl (1S,2R,3R,4R,6S)-5-Oxotricyclo[2.2.1.02,6]heptane-3-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/176019-19-5.gif)
![CAS 176027-90-0 Bicyclo[3.1.0]hexane-2,6-dicarboxylic acid, 2-amino-, (1R,2R,5S,6R)-rel- (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/176027-90-0.gif)
