CAS RN: 69039-11-8
(TERT-BUTYLIMINO)TRIS(DIMETHYLAMINO)TANTALUM
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.20250126 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS69039-11-8
- Purity/Analytical Methods: >99.0%
69039-11-8 / tert-butyliminotantalum;tris(dimethylazanide)
Basic Information
CAS
69039-11-8
Multi CAS
Yes
Molecular Formula
C10H27N4TA-3
Molecular Weight
384.300000
Exact Mass
384.171570
InChI
InChI=1S/C4H9N.3C2H6N.Ta/c1-4(2,3)5;3*1-3-2;/h1-3H3;3*1-2H3;/q;3*-1;
InChIKey
SYMKICRWMGYUAR-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
1
Molar refractivity
67.8
TPSA
54.66
LogP / Solubility
WLOGP
3.37
MLOGP
2.99
XLogP3
3.37
Consensus LogP
3.24
Log S (ESOL)
-4.35
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.15
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.96
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.67
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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