CAS RN: 2227198-81-2
(3R,6S)-6-Methylpiperidin-3-Ol Hydrochloride(WX601063)
- Product code: SSC-107425
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: 0.05g, 0.1g, 0.25g
- 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.
2227198-81-2 / (3R,6S)-6-methylpiperidin-3-ol;hydrochloride
Basic Information
CAS
2227198-81-2
Multi CAS
No
Molecular Formula
C6H14ClNO
Molecular Weight
151.630000
Exact Mass
151.076392
SMILES
C[C@H]1CC[C@H](CN1)O.Cl
InChI
InChI=1S/C6H13NO.ClH/c1-5-2-3-6(8)4-7-5;/h5-8H,2-4H2,1H3;1H/t5-,6+;/m0./s1
InChIKey
PVOAKSPCPLYSNC-RIHPBJNCSA-N
Computed Properties
Structural Parameters
Heavy atom count
9
Fraction Csp3
1
H-bond acceptors
2
H-bond donors
2
Molar refractivity
39.95
TPSA
32.26
LogP / Solubility
WLOGP
0.54
MLOGP
0.47
XLogP3
0.54
Consensus LogP
0.52
Log S (ESOL)
-1.12
Class (ESOL)
Soluble
Log S (Ali)
-1.19
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.09
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)
-3.26
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 2227198-84-5 2-Thiophenecarboxamide, 5-(difluoromethyl)-N-[1-[[(2S)-1-(1-oxo-2-propen-1-yl)-2-pyrrolidinyl]methyl]-5-[[[(1S)-1,2,2-trimethylpropyl]amino]methyl]-1H-benzimidazol-2-yl]- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
2-Thiophenecarboxamide, 5-(difluoromethyl)-N-[1-[[(2S)-1-(1-oxo-2-propen-1-yl)-2-pyrrolidinyl]methyl]-5-[[[(1S)-1,2,2-trimethylpropyl]amino]methyl]-1H-benzimidazol-2-yl]-
- CAS RN: 2227198-84-5
- Product Code: starshine_CAS2227198-84-5
- Purity/Analytical method: >99.0%
-
cis-1,3-dihydroxycyclobutane-1-carboxylic acid
- CAS RN: 2227198-91-4
- Product Code: starshine_CAS2227198-91-4
- Purity/Analytical method: >99.0%
-
(2S)-N-(4-chlorophenyl)-2-[cis-4-(6-fluoroquinolin-4-yl)cyclohexyl]propanamide
- CAS RN: 2227198-92-5
- Product Code: starshine_CAS2227198-92-5
- Purity/Analytical method: >99.0%
-
ethyl (1S,3S,4R)-4-bromo-3-hydroxycyclohexane-1-carboxylate
- CAS RN: 2227198-93-6
- Product Code: SSC-107427
-
-
(3S)-1-benzhydryl-2,2-dimethyl-azetidin-3-ol
- CAS RN: 2227199-01-9
- Product Code: SSC-107431
![CAS 2227198-84-5 2-Thiophenecarboxamide, 5-(difluoromethyl)-N-[1-[[(2S)-1-(1-oxo-2-propen-1-yl)-2-pyrrolidinyl]methyl]-5-[[[(1S)-1,2,2-trimethylpropyl]amino]methyl]-1H-benzimidazol-2-yl]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/2227198-84-5.gif)
![CAS 2227198-92-5 (2S)-N-(4-chlorophenyl)-2-[cis-4-(6-fluoroquinolin-4-yl)cyclohexyl]propanamide molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB93358369.gif)
