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CAS 1027710-05-9 Ethyl cis-N-Boc-3-phenylpiperidine-4-carboxylate molecular structure lightbox
CAS RN: 1027710-05-9

Ethyl cis-N-Boc-3-phenylpiperidine-4-carboxylate

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250721 250mg / 1g Out of stock 5-7 business days Inquiry
  • Product code: SSC-004119
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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: 0.1g, 0.25g, 1g, 5g, 10g
  • Available purity: >95%
  • Inventory rows with stock: 10
  • 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 1027710-05-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g -- 4 In Stock Hong Kong Inquiry
0.1g >95% 4 In Stock Shanghai Inquiry
0.25g -- 4 In Stock Shenzhen Inquiry
0.25g >95% 4 In Stock Shanghai Inquiry
1g -- 4 In Stock Shanghai Inquiry
1g >95% 4 In Stock Shanghai Inquiry
5g -- 4 In Stock Shanghai Inquiry
5g >95% 4 In Stock Shenzhen Inquiry
10g -- 4 In Stock Beijing Inquiry
10g >95% 4 In Stock Hong Kong Inquiry

1027710-05-9 / 1-O-tert-butyl 4-O-ethyl (3R,4S)-3-phenylpiperidine-1,4-dicarboxylate

Ethyl cis-N-Boc-3-phenylpiperidine-4-carboxylate | Ethylcis-N-Boc-3-phenylpiperidine-4-carboxylate | SCHEMBL1105755

Standard CAS: 1027710-05-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
1027710-05-9
Multi CAS
Yes
Molecular Formula
C19H27NO4
Molecular Weight
333.400000
Exact Mass
333.194008
SMILES
CCOC(=O)[C@H]1CCN(C[C@H]1C2=CC=CC=C2)C(=O)OC(C)(C)C
InChI
InChI=1S/C19H27NO4/c1-5-23-17(21)15-11-12-20(18(22)24-19(2,3)4)13-16(15)14-9-7-6-8-10-14/h6-10,15-16H,5,11-13H2,1-4H3/t15-,16-/m0/s1
InChIKey
RUKNPFBJQDRKIS-HOTGVXAUSA-N
Synonyms
Ethyl cis-N-Boc-3-phenylpiperidine-4-carboxylate Ethylcis-N-Boc-3-phenylpiperidine-4-carboxylate SCHEMBL1105755 AKOS027256592 rel-(3R,4S)-1-(tert-Butoxycarbonyl)-3-phenylpiperidine-4-carboxylic acid ethyl ester

Computed Properties

Structural Parameters

Heavy atom count
24
Aromatic heavy atom count
6
Fraction Csp3
0.58
Rotatable bonds
3
H-bond acceptors
4
Molar refractivity
91.73
TPSA
55.84

LogP / Solubility

WLOGP
3.59
MLOGP
3.18
XLogP3
3.2
Consensus LogP
3.32
Log S (ESOL)
-4.16
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.89
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.17
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.2

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5

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