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CAS 162955-48-8 (S)-(-)-N-Boc-2-Amino-1,5-pentanediol molecular structure lightbox
CAS RN: 162955-48-8

(S)-(-)-N-Boc-2-Amino-1,5-pentanediol

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250215 1g / 5g Confirm by inquiry Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250304 100mg In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250307 10g In stock Shanghai Inquiry
Batchno.20250223 1g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20251026 250mg In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20250117 25g In stock Shanghai Inquiry
Batchno.20251211 5g In stock Shanghai Inquiry
  • Product code: SSC-070473
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 162955-48-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Beijing Inquiry

162955-48-8 / tert-butyl N-[(2S)-1,5-dihydroxypentan-2-yl]carbamate

Standard CAS: 162955-48-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
162955-48-8
Multi CAS
No
Molecular Formula
C10H21NO4
Molecular Weight
219.280000
Exact Mass
219.147058
SMILES
CC(C)(C)OC(=O)N[C@@H](CCCO)CO
InChI
InChI=1S/C10H21NO4/c1-10(2,3)15-9(14)11-8(7-13)5-4-6-12/h8,12-13H,4-7H2,1-3H3,(H,11,14)/t8-/m0/s1
InChIKey
UBNNKNSFDFANKW-QMMMGPOBSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.9
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
3
Molar refractivity
56.56
TPSA
78.79

LogP / Solubility

WLOGP
0.64
MLOGP
0.57
XLogP3
0.3
Consensus LogP
0.5
Log S (ESOL)
-1.28
Class (ESOL)
Soluble
Log S (Ali)
-1.82
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.22
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.6

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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