CAS RN: 468747-17-3
mTOR Inhibitor-1
Product Availability
Choose a grade to view its available package options.
8 package records5 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260611 | 5mg / 10mg / 25mg / 50mg | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250124 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20250604 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20250617 | 1g | Out of stock | Inquiry | ||
| Batchno.20250409 | 250mg | Out of stock | Inquiry | ||
| Batchno.20250122 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250123 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250103 | 5mg | In stock | Shanghai | Inquiry |
- Product code: ICTT3934
- Purity/Analytical Methods: >98.0%(HPLC)
468747-17-3 / 3-bromo-N-[1-(2,4-dihydroxyphenyl)ethylideneamino]-4-methylbenzamide
Basic Information
CAS
468747-17-3
Multi CAS
Yes
Molecular Formula
BC16H15O3Rn2
Molecular Weight
363.210000
Exact Mass
362.026600
InChI
InChI=1S/C16H15BrN2O3/c1-9-3-4-11(7-14(9)17)16(22)19-18-10(2)13-6-5-12(20)8-15(13)21/h3-8,20-21H,1-2H3,(H,19,22)
InChIKey
NKMSVTGHOVMMHV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
22
Aromatic heavy atom count
12
Fraction Csp3
0.12
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
3
Molar refractivity
88.33
TPSA
81.92
LogP / Solubility
WLOGP
3.32
MLOGP
2.94
XLogP3
3.4
Consensus LogP
3.22
Log S (ESOL)
-4.39
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.94
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.14
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.58
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5
