CAS RN: 761438-38-4
ALK inhibitor 2
Product Availability
Choose a grade to view its available package options.
7 package records3 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250512 | 100mg | Out of stock | Inquiry | |
| Batchno.20260323 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251227 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20260525 | 250mg | Out of stock | Inquiry | |
| Batchno.20251029 | 25mg | Out of stock | Inquiry | |
| Batchno.20251127 | 50mg | Out of stock | Inquiry | |
| Batchno.20250104 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS761438-38-4
- Purity/Analytical Methods: >99.0%
761438-38-4 / 2-[[5-chloro-2-[2-methoxy-4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4-yl]amino]-N-methylbenzenesulfonamide
Basic Information
CAS
761438-38-4
Multi CAS
No
Molecular Formula
C23H28CLN7O3S
Molecular Weight
518.000000
Exact Mass
517.166287
InChI
InChI=1S/C23H28ClN7O3S/c1-25-35(32,33)21-7-5-4-6-19(21)27-22-17(24)15-26-23(29-22)28-18-9-8-16(14-20(18)34-3)31-12-10-30(2)11-13-31/h4-9,14-15,25H,10-13H2,1-3H3,(H2,26,27,28,29)
InChIKey
NURCYJBMLKNYHB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
35
Aromatic heavy atom count
18
Fraction Csp3
0.3
Rotatable bonds
8
H-bond acceptors
9
H-bond donors
3
Molar refractivity
139
TPSA
111.72
LogP / Solubility
WLOGP
3.29
MLOGP
2.93
XLogP3
4
Consensus LogP
3.41
Log S (ESOL)
-4.97
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.18
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.71
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
Customers Also Viewed
-
-
1H-Isoindol-1-one,7-amino-2,3-dihydro-2-methyl-(9CI)
- CAS RN: 761440-06-6
- Product Code: SSC-185587
-
BenzenesulfonaMide, 2-[(2,5-dichloro-4-pyriMidinyl)aMino]-N-Methyl-
- CAS RN: 761440-11-3
- Product Code: SSC-185588
-
-
1-(3-Methoxy-4-nitrophenyl)-4-Methylpiperazine
- CAS RN: 761440-26-0
- Product Code: SSC-185591
-
1-(1-(3-Methoxy-4-nitrophenyl)piperidin-4-yl)-4-Methylpiperazine
- CAS RN: 761440-65-7
- Product Code: SSC-185592
![CAS 761440-11-3 BenzenesulfonaMide, 2-[(2,5-dichloro-4-pyriMidinyl)aMino]-N-Methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/761440-11-3.gif)
