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CAS 1421312-30-2 2-amino-2-(1-(tert-butoxycarbonyl)piperidin-4-yl)aceticacid molecular structure lightbox
CAS RN: 1421312-30-2

2-amino-2-(1-(tert-butoxycarbonyl)piperidin-4-yl)aceticacid

  • Product code: SSC-052857
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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: 1g, 5g, 10g, 0.1g, 0.25g
  • Available purity: >95%
  • Inventory rows with stock: 8
  • 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 1421312-30-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g -- 5 In Stock Beijing Inquiry
5g -- 5 In Stock Beijing Inquiry
10g -- 5 In Stock Shanghai Inquiry
1g >95% 3 In Stock Shenzhen Inquiry
0.1g -- 2 In Stock Shanghai Inquiry
0.25g -- 2 In Stock Shanghai Inquiry
0.1g >95% 1 In Stock Hong Kong Inquiry
0.25g >95% 1 In Stock Shanghai Inquiry
5g >95% 0 Out of Stock Shanghai Inquiry
10g >95% 0 Out of Stock Shanghai Inquiry

1421312-30-2 / 2-amino-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]acetic acid

Standard CAS: 1421312-30-2 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1421312-30-2
Multi CAS
No
Molecular Formula
C12H22N2O4
Molecular Weight
258.310000
Exact Mass
258.157957
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)C(C(=O)O)N
InChI
InChI=1S/C12H22N2O4/c1-12(2,3)18-11(17)14-6-4-8(5-7-14)9(13)10(15)16/h8-9H,4-7,13H2,1-3H3,(H,15,16)
InChIKey
UPEUKKCILASJSH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
0.83
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
66.14
TPSA
92.86

LogP / Solubility

WLOGP
1.05
MLOGP
0.93
XLogP3
-1.7
Consensus LogP
0.09
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.43
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.45
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
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2

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