CAS RN: 441764-42-7
(2S,4S)-1-(Benzyloxycarbonyl)-4-Hydroxypiperidine-2-Carboxylic Acid(WX610029)
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.20260321 | 50mg / 100mg / 250mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS441764-42-7
- Purity/Analytical Methods: >99.0%
441764-42-7 / 4-hydroxy-1-phenylmethoxycarbonylpiperidine-2-carboxylic acid
Basic Information
CAS
441764-42-7
Multi CAS
Yes
Molecular Formula
C14H17NO5
Molecular Weight
279.290000
Exact Mass
279.110673
InChI
InChI=1S/C14H17NO5/c16-11-6-7-15(12(8-11)13(17)18)14(19)20-9-10-4-2-1-3-5-10/h1-5,11-12,16H,6-9H2,(H,17,18)/t11-,12-/m0/s1
InChIKey
FTYFCFPNHFHPBH-RYUDHWBXSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
6
Fraction Csp3
0.43
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
70
TPSA
87.07
LogP / Solubility
WLOGP
1.23
MLOGP
1.09
XLogP3
1.1
Consensus LogP
1.14
Log S (ESOL)
-2.37
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.74
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
Customers Also Viewed
-
-
tert-Butyl 3-(hydroxymethyl)-3-(prop-2-en-1-yl)piperidine-1-carboxylate
- CAS RN: 441773-93-9
- Product Code: SSC-152184
-
1,4-Piperidinedicarboxylic acid, 4-(2-propenyl)-, 1-(1,1-dimethylethyl) 4-methyl ester
- CAS RN: 441774-09-0
- Product Code: SSC-152185
-
[1-(tert-Butyldiphenylsilanyloxymethyl)-cyclopropyl]-methanol
- CAS RN: 441785-04-2
- Product Code: SSC-152188
-
PHOSPHONIC ACID, [[[1-[(2-AMINO-9H-PURIN-9-YL)METHYL]CYCLOPROPYL]OXY]METHYL]- (9CI)
- CAS RN: 441785-25-7
- Product Code: starshine_CAS441785-25-7
- Purity/Analytical method: >99.0%
-
2-(Ethoxycarbonyl)-1H-indole-3-carboxylic acid
- CAS RN: 441800-93-7
- Product Code: SSC-152192
![CAS 441785-04-2 [1-(tert-Butyldiphenylsilanyloxymethyl)-cyclopropyl]-methanol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/441785-04-2.gif)
![CAS 441785-25-7 PHOSPHONIC ACID, [[[1-[(2-AMINO-9H-PURIN-9-YL)METHYL]CYCLOPROPYL]OXY]METHYL]- (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/441785-25-7.gif)
