CAS RN: 39756-32-6
EICOSANOIC-D39 ACID
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.20260121 | 250mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS39756-32-6
- Purity/Analytical Methods: >99.0%
39756-32-6 / 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,20-nonatriacontadeuterioicosanoic acid
Basic Information
CAS
39756-32-6
Multi CAS
Yes
Molecular Formula
C20H40O2
Molecular Weight
351.800000
Exact Mass
351.547624
InChI
InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2
InChIKey
VKOBVWXKNCXXDE-BKDZISOFSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Fraction Csp3
0.95
Rotatable bonds
18
H-bond acceptors
1
H-bond donors
1
Molar refractivity
96.42
TPSA
37.3
LogP / Solubility
WLOGP
7.11
MLOGP
6.27
XLogP3
8.5
Consensus LogP
7.29
Log S (ESOL)
-5.07
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.26
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-9.76
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
0.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
N-NONADECANE-D40
- CAS RN: 39756-36-0
- Product Code: starshine_CAS39756-36-0
- Purity/Analytical method: >99.0%
-
-
METHYL 4-(4-METHOXYPHENYL)-2,4-DIOXOBUTANOATE
- CAS RN: 39757-31-8
- Product Code: SSC-147493
-
METHYL 4-(2,4-DIMETHOXYPHENYL)-2,4-DIOXOBUTANOATE
- CAS RN: 39757-32-9
- Product Code: SSC-147494
-
-
