![CAS 368866-09-5 4-Piperidinecarboxylicacid,4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-,monohydrochloride(9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/368866-09-5(2).gif)
CAS RN: 368866-09-5
4-Piperidinecarboxylicacid,4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-,monohydrochloride(9CI)
- Product code: SSC-144147
Verified Factory Data
Supply Overview & Packaging Options
Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 0.1g, 0.25g, 1g, 5g
- Available purity: >95%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
Available Pack Sizes & Stock
Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.
368866-09-5 / 4-(9H-fluoren-9-ylmethoxycarbonylamino)piperidine-4-carboxylic acid;hydrochloride
Basic Information
CAS
368866-09-5
Multi CAS
No
Molecular Formula
C21H23CLN2O4
Molecular Weight
402.900000
Exact Mass
402.134635
InChI
InChI=1S/C21H22N2O4.ClH/c24-19(25)21(9-11-22-12-10-21)23-20(26)27-13-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18;/h1-8,18,22H,9-13H2,(H,23,26)(H,24,25);1H
InChIKey
UDBFKLWITSYZJD-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
12
Fraction Csp3
0.33
Rotatable bonds
4
H-bond acceptors
4
H-bond donors
3
Molar refractivity
107.92
TPSA
87.66
LogP / Solubility
WLOGP
3.15
MLOGP
2.8
XLogP3
3.15
Consensus LogP
3.03
Log S (ESOL)
-4.38
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.14
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.38
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.94
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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![CAS 368866-21-1 1,3-Piperidinedicarboxylicacid,3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-,1-(1,1-dimethylethyl)ester(9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/368866-21-1(2).gif)
.gif)
![CAS 368866-33-5 (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(oxan-4-yl)propanoic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/368866-33-5(2).gif)