CAS RN: 600116-15-2
tBuPO(NHiPr)2
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260126 | 100mg / 500mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS600116-15-2
- Purity/Analytical Methods: >99.0%
600116-15-2 / N-[tert-butyl-(propan-2-ylamino)phosphoryl]propan-2-amine
Basic Information
CAS
600116-15-2
Multi CAS
No
Molecular Formula
C10H25N2OP
Molecular Weight
220.290000
Exact Mass
220.170450
InChI
InChI=1S/C10H25N2OP/c1-8(2)11-14(13,10(5,6)7)12-9(3)4/h8-9H,1-7H3,(H2,11,12,13)
InChIKey
PTTBIXBXKOERJH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
14
Fraction Csp3
1
Rotatable bonds
4
H-bond acceptors
1
H-bond donors
2
Molar refractivity
63.9
TPSA
41.13
LogP / Solubility
WLOGP
2.97
MLOGP
2.62
XLogP3
1.5
Consensus LogP
2.36
Log S (ESOL)
-2.82
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.51
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.04
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.95
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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