![CAS 604769-01-9 5-Pyrimidinecarboxamide, N-hydroxy-2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]- (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/604769-01-9.gif)
CAS RN: 604769-01-9
5-Pyrimidinecarboxamide, N-hydroxy-2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]- (9CI)
Product Availability
Choose a grade to view its available package options.
8 package records7 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250621 | 5mg / 10mg | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260607 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260312 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251101 | 1mg | Out of stock | Inquiry | |
| Batchno.20250905 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20250116 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20250926 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250329 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS604769-01-9
- Purity/Analytical Methods: >99.0%
604769-01-9 / N-hydroxy-2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)pyrimidine-5-carboxamide
Basic Information
CAS
604769-01-9
Multi CAS
No
Molecular Formula
C19H19N5O4S
Molecular Weight
413.500000
Exact Mass
413.115775
InChI
InChI=1S/C19H19N5O4S/c25-18(22-26)16-12-20-19(21-13-16)23-7-9-24(10-8-23)29(27,28)17-6-5-14-3-1-2-4-15(14)11-17/h1-6,11-13,26H,7-10H2,(H,22,25)
InChIKey
MUTBJZVSRNUIHA-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
29
Aromatic heavy atom count
16
Fraction Csp3
0.21
Rotatable bonds
4
H-bond acceptors
7
H-bond donors
2
Molar refractivity
106.2
TPSA
115.73
LogP / Solubility
WLOGP
1.26
MLOGP
1.13
XLogP3
1.3
Consensus LogP
1.23
Log S (ESOL)
-3.34
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.86
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.87
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-4.35
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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