CAS RN: 35019-66-0
(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-amine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Inquiry |
|---|---|---|---|
| Batchno.20250823 | 100mg | Out of stock | Inquiry |
- Product code: starshine_CAS35019-66-0
- Purity/Analytical Methods: >99.0%
35019-66-0 / 2,2-dimethyl-4-phenyl-1,3-dioxan-5-amine
Basic Information
CAS
35019-66-0
Multi CAS
Yes
Molecular Formula
C12H17NO2
Molecular Weight
207.270000
Exact Mass
207.125929
InChI
InChI=1S/C12H17NO2/c1-12(2)14-8-10(13)11(15-12)9-6-4-3-5-7-9/h3-7,10-11H,8,13H2,1-2H3/t10-,11-/m0/s1
InChIKey
ILNGCJMEDIBPTL-QWRGUYRKSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
1
Molar refractivity
58.27
TPSA
44.48
LogP / Solubility
WLOGP
1.84
MLOGP
1.62
XLogP3
1.1
Consensus LogP
1.52
Log S (ESOL)
-2.51
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.59
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.65
Class (SILICOS-IT)
Moderately 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)
-2.68
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
Customers Also Viewed
-
DANSYL-L-ALANINE PIPERIDINIUM SALT
- CAS RN: 35021-10-4
- Product Code: starshine_CAS35021-10-4
- Purity/Analytical method: >99.0%
-
-
H-L-MEALA-OME HCL
- CAS RN: 35023-55-3
- Product Code: starshine_CAS35023-55-3
- Purity/Analytical method: >99.0%
-
-
L-3-(p-Methoxyphenyl)-2-Methylalanine
- CAS RN: 35026-10-9
- Product Code: starshine_CAS35026-10-9
- Purity/Analytical method: >99.0%
-
2′,3′-DIMETHYLPROPIOPHENONE
- CAS RN: 35028-14-9
- Product Code: starshine_CAS35028-14-9
- Purity/Analytical method: >99.0%
