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CAS 566905-88-2 4-(1-Cbz-4-piperidyl)-1-butanol molecular structure lightbox
CAS RN: 566905-88-2

4-(1-Cbz-4-piperidyl)-1-butanol

  • Product code: SSC-164726
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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: 0.25g, 0.1g, 1g, 5g
  • Available purity: >95%
  • Inventory rows with stock: 6
  • 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 566905-88-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g -- 2 In Stock Shanghai Inquiry
0.25g >95% 2 In Stock Hong Kong Inquiry
0.1g -- 1 In Stock Beijing Inquiry
0.1g >95% 1 In Stock Hong Kong Inquiry
1g -- 1 In Stock Beijing Inquiry
1g >95% 1 In Stock Shanghai Inquiry
5g -- 0 Out of Stock Beijing Inquiry
5g >95% 0 Out of Stock Shenzhen Inquiry

566905-88-2 / benzyl 4-(4-hydroxybutyl)piperidine-1-carboxylate

Standard CAS: 566905-88-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
566905-88-2
Multi CAS
No
Molecular Formula
C17H25NO3
Molecular Weight
291.400000
Exact Mass
291.183444
InChI
InChI=1S/C17H25NO3/c19-13-5-4-6-15-9-11-18(12-10-15)17(20)21-14-16-7-2-1-3-8-16/h1-3,7-8,15,19H,4-6,9-14H2
InChIKey
ONJUEYJIUIRIBU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
6
Fraction Csp3
0.59
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
1
Molar refractivity
81.86
TPSA
49.77

LogP / Solubility

WLOGP
3.2
MLOGP
2.83
XLogP3
2.9
Consensus LogP
2.98
Log S (ESOL)
-3.48
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.26
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.93
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.23

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2.5

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