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CAS 1095010-46-0 1-Cbz-5-Hydroxypiperidine-3-carboxylic Acid molecular structure lightbox
CAS RN: 1095010-46-0

1-Cbz-5-Hydroxypiperidine-3-carboxylic Acid

  • Product code: SSC-010894
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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: 5g, 0.1g, 0.25g, 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1095010-46-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥95% 4 In Stock Shanghai Inquiry
0.1g ≥95% 1 In Stock Shanghai Inquiry
0.25g ≥95% 1 In Stock Shenzhen Inquiry
1g ≥95% 1 In Stock Beijing Inquiry

1095010-46-0 / 5-hydroxy-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid

1-Cbz-5-Hydroxypiperidine-3-carboxylic Acid | MFCD11656769 | 1-[(Benzyloxy)carbonyl]-5-hydroxypiperidine-3-carboxylic acid

Standard CAS: 1095010-46-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1095010-46-0
Multi CAS
Yes
Molecular Formula
C14H17NO5
Molecular Weight
279.290000
Exact Mass
279.110673
SMILES
C1C(CN(CC1O)C(=O)OCC2=CC=CC=C2)C(=O)O
InChI
InChI=1S/C14H17NO5/c16-12-6-11(13(17)18)7-15(8-12)14(19)20-9-10-4-2-1-3-5-10/h1-5,11-12,16H,6-9H2,(H,17,18)
InChIKey
SLBOCRNMAOXNRL-UHFFFAOYSA-N
Synonyms
1-Cbz-5-Hydroxypiperidine-3-carboxylic Acid MFCD11656769 1-[(Benzyloxy)carbonyl]-5-hydroxypiperidine-3-carboxylic acid 5-hydroxy-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid 1-((Benzyloxy)carbonyl)-5-hydroxypiperidine-3-carboxylic acid

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
69.95
TPSA
87.07

LogP / Solubility

WLOGP
1.09
MLOGP
0.97
XLogP3
0.7
Consensus LogP
0.92
Log S (ESOL)
-2.28
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.64
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.74
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)
-3.65

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5

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