CAS RN: 1342278-01-6
RKI1447
Product Availability
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10 package records7 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250620 | 100mg | Out of stock | Inquiry | |
| Batchno.20250129 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20260208 | 1g | Out of stock | Inquiry | |
| Batchno.20251205 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250523 | 250mg | Out of stock | Inquiry | |
| Batchno.20250406 | 25mg | In stock | Shanghai | Inquiry |
| Batchno.20251121 | 5mg | In stock | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260204 | 1ml | In stock | Inquiry |
- Product code: starshine_CAS1342278-01-6
- Purity/Analytical Methods: >99.0%
1342278-01-6 / 1-[(3-hydroxyphenyl)methyl]-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)urea
Basic Information
CAS
1342278-01-6
Multi CAS
No
Molecular Formula
C16H14N4O2S
Molecular Weight
326.400000
Exact Mass
326.083747
SMILES
C1=CC(=CC(=C1)O)CNC(=O)NC2=NC(=CS2)C3=CC=NC=C3
InChI
InChI=1S/C16H14N4O2S/c21-13-3-1-2-11(8-13)9-18-15(22)20-16-19-14(10-23-16)12-4-6-17-7-5-12/h1-8,10,21H,9H2,(H2,18,19,20,22)
InChIKey
GDVRVPIXWXOKQO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
17
Fraction Csp3
0.06
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
3
Molar refractivity
89.31
TPSA
87.14
LogP / Solubility
WLOGP
3.23
MLOGP
2.86
XLogP3
2
Consensus LogP
2.7
Log S (ESOL)
-4.18
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.57
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.94
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
No
Log Kp (skin permeation)
-2.42
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
2.5
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