CAS RN: 574744-39-1
(S)-(-)-1-(4-METHOXYPHENYL)ETHYLAMINE-HCl
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.20260604 | 100mg / 250mg / 1g | Confirm by inquiry | Shanghai | Inquiry |
- Product code: starshine_CAS574744-39-1
- Purity/Analytical Methods: >99.0%
574744-39-1 / 1-(4-methoxyphenyl)ethanamine;hydrochloride
Basic Information
CAS
574744-39-1
Multi CAS
Yes
Molecular Formula
C9H14CLNO
Molecular Weight
187.660000
Exact Mass
187.076392
InChI
InChI=1S/C9H13NO.ClH/c1-7(10)8-3-5-9(11-2)6-4-8;/h3-7H,10H2,1-2H3;1H/t7-;/m0./s1
InChIKey
FYLBCUWOAFIYOW-FJXQXJEOSA-N
Computed Properties
Structural Parameters
Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.33
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
52.84
TPSA
35.25
LogP / Solubility
WLOGP
2.14
MLOGP
1.88
XLogP3
2.14
Consensus LogP
2.05
Log S (ESOL)
-2.59
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.64
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.89
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)
-2.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
-
2-PYRIMIDINAMINE, 4-(3-CHLOROPHENYL)-N-[4-(TRIFLUOROMETHYL)PHENYL]-
- CAS RN: 574759-62-9
- Product Code: SSC-165636
-
Notoginsenoside S
- CAS RN: 575446-95-6
- Product Code: starshine_CAS575446-95-6
- Purity/Analytical method: >99.0%
-
S-5,5′,6,6′,7,7′,8,8′-octahydro-3,3′-diphenyl-[1,1′-Binaphthalene]-2,2′-diol
- CAS RN: 575451-08-0
- Product Code: starshine_CAS575451-08-0
- Purity/Analytical method: >99.0%
-
-
![CAS 574759-62-9 2-PYRIMIDINAMINE, 4-(3-CHLOROPHENYL)-N-[4-(TRIFLUOROMETHYL)PHENYL]- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/574759-62-9.gif)
![CAS 575451-08-0 S-5,5′,6,6′,7,7′,8,8′-octahydro-3,3′-diphenyl-[1,1′-Binaphthalene]-2,2′-diol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/575451-08-0.gif)
