CAS RN: 545380-34-5
QNZ
Product Availability
Choose a grade to view its available package options.
9 package records8 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20251123 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20251212 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260213 | 1g | Out of stock | Inquiry | |
| Batchno.20251111 | 1mg | In stock | Shanghai, Tianjin, Wuhan | Inquiry |
| Batchno.20260216 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250527 | 25mg | In stock | Hebei | Inquiry |
| Batchno.20250812 | 50mg | In stock | Shanghai, Wuhan | Inquiry |
| Batchno.20250810 | 5mg | In stock | Shanghai | Inquiry |
| Batchno.20250719 | 5mg | In stock | Shandong | Inquiry |
- Product code: ICTQ0109
- Purity/Analytical Methods: >98.0%(HPLC)
545380-34-5 / 4-N-[2-(4-phenoxyphenyl)ethyl]quinazoline-4,6-diamine
Basic Information
CAS
545380-34-5
Multi CAS
Yes
Molecular Formula
C22H20N4O
Molecular Weight
356.400000
Exact Mass
356.163711
InChI
InChI=1S/C22H20N4O/c23-17-8-11-21-20(14-17)22(26-15-25-21)24-13-12-16-6-9-19(10-7-16)27-18-4-2-1-3-5-18/h1-11,14-15H,12-13,23H2,(H,24,25,26)
InChIKey
IBAKVEUZKHOWNG-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
22
Fraction Csp3
0.09
Rotatable bonds
6
H-bond acceptors
5
H-bond donors
2
Molar refractivity
109.1
TPSA
73.06
LogP / Solubility
WLOGP
4.66
MLOGP
4.12
XLogP3
4.7
Consensus LogP
4.49
Log S (ESOL)
-5.19
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.85
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.56
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.59
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
3
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