![CAS 7732-36-7 2-[(2-amino-5-methoxyphenyl)dithio]-4-methoxyaniline molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB12132665.gif)
CAS RN: 7732-36-7
2-[(2-amino-5-methoxyphenyl)dithio]-4-methoxyaniline
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.20260509 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS7732-36-7
- Purity/Analytical Methods: >99.0%
7732-36-7 / 2-[(2-amino-5-methoxyphenyl)disulfanyl]-4-methoxyaniline
Basic Information
CAS
7732-36-7
Multi CAS
Yes
Molecular Formula
C14H16N2O2S2
Molecular Weight
308.400000
Exact Mass
308.065320
InChI
InChI=1S/C14H16N2O2S2/c1-17-9-3-5-11(15)13(7-9)19-20-14-8-10(18-2)4-6-12(14)16/h3-8H,15-16H2,1-2H3
InChIKey
GWEVTUVEXHHEPF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
12
Fraction Csp3
0.14
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
2
Molar refractivity
86.53
TPSA
70.5
LogP / Solubility
WLOGP
3.67
MLOGP
3.24
XLogP3
2.6
Consensus LogP
3.17
Log S (ESOL)
-4.18
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.74
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.31
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
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