CAS RN: 29980-16-3
N-DODECYL A-D-GLUCOPYRANOSIDE
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260223 | 50mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS29980-16-3
- Purity/Analytical Methods: >99.0%
29980-16-3 / (2S,3R,4S,5S,6R)-2-dodecoxy-6-(hydroxymethyl)oxane-3,4,5-triol
Basic Information
CAS
29980-16-3
Multi CAS
Yes
Molecular Formula
C18H36O6
Molecular Weight
348.500000
Exact Mass
348.251189
InChI
InChI=1S/C18H36O6/c1-2-3-4-5-6-7-8-9-10-11-12-23-18-17(22)16(21)15(20)14(13-19)24-18/h14-22H,2-13H2,1H3/t14-,15-,16+,17-,18+/m1/s1
InChIKey
PYIDGJJWBIBVIA-SFFUCWETSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Fraction Csp3
1
Rotatable bonds
13
H-bond acceptors
6
H-bond donors
4
Molar refractivity
91.56
TPSA
99.38
LogP / Solubility
WLOGP
1.72
MLOGP
1.53
XLogP3
3.5
Consensus LogP
2.25
Log S (ESOL)
-2.23
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.66
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.92
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
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)
-3.62
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
5
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