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CAS 361154-30-5 N-azidoacetylmannosamine-tetraacylated molecular structure lightbox
CAS RN: 361154-30-5

N-azidoacetylmannosamine-tetraacylated

  • Product code: SSC-143233
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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: 0.1g, 0.25g, 1g
  • Available purity: ≥ 85.0%
  • 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 361154-30-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥ 85.0% 0 Out of Stock Beijing Inquiry
0.25g ≥ 85.0% 0 Out of Stock Hong Kong Inquiry
1g ≥ 85.0% 0 Out of Stock Shanghai Inquiry

361154-30-5 / [3,4,6-triacetyloxy-5-[(2-azidoacetyl)amino]oxan-2-yl]methyl acetate

Standard CAS: 361154-30-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
361154-30-5
Multi CAS
Yes
Molecular Formula
C16H22N4O10
Molecular Weight
430.370000
Exact Mass
430.133593
InChI
InChI=1S/C16H22N4O10/c1-7(21)26-6-11-14(27-8(2)22)15(28-9(3)23)13(16(30-11)29-10(4)24)19-12(25)5-18-20-17/h11,13-16H,5-6H2,1-4H3,(H,19,25)/t11-,13+,14-,15-,16?/m1/s1
InChIKey
HGMISDAXLUIXKM-LIADDWGISA-N

Computed Properties

Structural Parameters

Heavy atom count
30
Fraction Csp3
0.69
Rotatable bonds
8
H-bond acceptors
11
H-bond donors
1
Molar refractivity
94.11
TPSA
192.29

LogP / Solubility

WLOGP
-0.5
MLOGP
-0.42
XLogP3
1.2
Consensus LogP
0.09
Log S (ESOL)
-1.66
Class (ESOL)
Soluble
Log S (Ali)
-2.73
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3
Class (SILICOS-IT)
Moderately 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)
-5.7

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5

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