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CAS 63223-57-4 N-Valeryl-D-glucosamine molecular structure lightbox
CAS RN: 63223-57-4

N-Valeryl-D-glucosamine

  • Product code: SSC-172824
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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: 1g
  • Available purity: >98%
  • 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 63223-57-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >98% 0 Out of Stock Hong Kong Inquiry

63223-57-4 / N-[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]pentanamide

Standard CAS: 63223-57-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
63223-57-4
Multi CAS
Yes
Molecular Formula
C11H21NO6
Molecular Weight
263.290000
Exact Mass
263.136887
InChI
InChI=1S/C11H21NO6/c1-2-3-4-7(14)12-8-10(16)9(15)6(5-13)18-11(8)17/h6,8-11,13,15-17H,2-5H2,1H3,(H,12,14)
InChIKey
FNSCSLWWUFMYHX-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
0.91
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
5
Molar refractivity
61.43
TPSA
119.25

LogP / Solubility

WLOGP
-1.91
MLOGP
-1.67
XLogP3
-0.3
Consensus LogP
-1.29
Log S (ESOL)
0.06
Class (ESOL)
Highly soluble
Log S (Ali)
-0.34
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.39
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.68

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4

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