CAS RN: 329689-23-8
MONASTROL
Product Availability
Choose a grade to view its available package options.
13 package records12 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260525 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260209 | 100mg / 250mg | Out of stock | 5-7 business days | Inquiry | |
| Batchno.20250920 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20251213 | 1g | In stock | Shanghai | Inquiry | |
| Batchno.20250514 | 1mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20260417 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20251221 | 25mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20260620 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20260402 | 5mg | In stock | Shanghai, Wuhan | Inquiry |
- Product code: starshine_CAS329689-23-8
- Purity/Analytical Methods: >99.0%
329689-23-8 / ethyl 4-(3-hydroxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Basic Information
CAS
329689-23-8
Multi CAS
Yes
Molecular Formula
C14H16N2O3S
Molecular Weight
292.360000
Exact Mass
292.088164
InChI
InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)
InChIKey
LOBCDGHHHHGHFA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
20
Aromatic heavy atom count
6
Fraction Csp3
0.29
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
3
Molar refractivity
79.05
TPSA
70.59
LogP / Solubility
WLOGP
1.75
MLOGP
1.55
XLogP3
1.6
Consensus LogP
1.63
Log S (ESOL)
-2.78
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.22
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.37
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.26
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2
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![CAS 329703-46-0 2H,6H-Benzo[1,2-b:5,4-b’]dipyran-6-one, 8-(3,4-dihydroxyphenyl)-7,8-dihydro-5-hydroxy-2,2-dimethyl-10-(3-methyl-2-buten-1-yl)-, (8S)- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/329703-46-0.gif)
