CAS RN: 499133-82-3
4-(2-METHYLQUINAZOLIN-4-YL)MORPHOLINE
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.20250425 | 1g | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS499133-82-3
- Purity/Analytical Methods: >99.0%
499133-82-3 / 4-(2-methylquinazolin-4-yl)morpholine
Basic Information
CAS
499133-82-3
Multi CAS
No
Molecular Formula
C13H15N3O
Molecular Weight
229.280000
Exact Mass
229.121512
InChI
InChI=1S/C13H15N3O/c1-10-14-12-5-3-2-4-11(12)13(15-10)16-6-8-17-9-7-16/h2-5H,6-9H2,1H3
InChIKey
YXURFJKRRDOICY-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
17
Aromatic heavy atom count
10
Fraction Csp3
0.38
Rotatable bonds
1
H-bond acceptors
4
Molar refractivity
67.31
TPSA
38.25
LogP / Solubility
WLOGP
1.77
MLOGP
1.57
XLogP3
2
Consensus LogP
1.78
Log S (ESOL)
-2.75
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.72
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.74
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.86
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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