CAS RN: 791132-77-9
WAY-640400
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.20250606 | 5mg / 10mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS791132-77-9
- Purity/Analytical Methods: >99.0%
791132-77-9 / 7-[[4-(4-acetylphenyl)piperazin-1-yl]methyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Basic Information
CAS
791132-77-9
Multi CAS
No
Molecular Formula
C19H20N4O2S
Molecular Weight
368.500000
Exact Mass
368.130697
InChI
InChI=1S/C19H20N4O2S/c1-14(24)15-2-4-17(5-3-15)22-8-6-21(7-9-22)13-16-12-18(25)23-10-11-26-19(23)20-16/h2-5,10-12H,6-9,13H2,1H3
InChIKey
GGYSKCYQCYAXNV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
26
Aromatic heavy atom count
15
Fraction Csp3
0.32
Rotatable bonds
4
H-bond acceptors
7
Molar refractivity
103.28
TPSA
57.92
LogP / Solubility
WLOGP
2.28
MLOGP
2.03
XLogP3
1.3
Consensus LogP
1.87
Log S (ESOL)
-3.72
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.23
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.43
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)
-3.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
-
-
-
-
(R)-3-Amino-3-(2-(trifluoromethyl)phenyl)propanoic acid
- CAS RN: 791582-16-6
- Product Code: starshine_CAS791582-16-6
- Purity/Analytical method: >99.0%
-
cFMS-IN-2
- CAS RN: 791587-67-2
- Product Code: starshine_CAS791587-67-2
- Purity/Analytical method: >99.0%
