CAS RN: 288383-71-1
4-Chloro-6-methoxy-7-(3-piperidin-1-yl-propoxy)-quinazoline
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.20250630 | 500mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS288383-71-1
- Purity/Analytical Methods: >99.0%
288383-71-1 / 4-chloro-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazoline
Basic Information
CAS
288383-71-1
Multi CAS
No
Molecular Formula
C17H22ClN3O2
Molecular Weight
335.800000
Exact Mass
335.140055
InChI
InChI=1S/C17H22ClN3O2/c1-22-15-10-13-14(19-12-20-17(13)18)11-16(15)23-9-5-8-21-6-3-2-4-7-21/h10-12H,2-9H2,1H3
InChIKey
QMPMEXBHMIYNGL-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
10
Fraction Csp3
0.53
Rotatable bonds
6
H-bond acceptors
5
Molar refractivity
91.5
TPSA
47.48
LogP / Solubility
WLOGP
3.55
MLOGP
3.14
XLogP3
3.7
Consensus LogP
3.46
Log S (ESOL)
-4.08
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.87
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.51
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)
-2.25
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
2.5
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