CAS RN: 1228280-29-2
KY 05009
Product Availability
Choose a grade to view its available package options.
9 package records4 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250510 | 5mg / 25mg / 100mg / 250mg | Out of stock | 5-7 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260327 | 100mg | Out of stock | Inquiry | ||
| Batchno.20250404 | 10mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20250310 | 1g | Out of stock | Inquiry | ||
| Batchno.20250502 | 1mg | In stock | Shanghai, Wuhan | Inquiry | |
| Batchno.20250717 | 250mg | Out of stock | Inquiry | ||
| Batchno.20260206 | 25mg | In stock | Shanghai, Shenzhen | Inquiry | |
| Batchno.20250717 | 50mg | Out of stock | Inquiry | ||
| Batchno.20260531 | 5mg | In stock | Shanghai, Wuhan | Inquiry |
- Product code: starshine_CAS1228280-29-2
- Purity/Analytical Methods: >99.0%
1228280-29-2 / 2-anilino-5-[(4-methylbenzoyl)amino]-1,3-thiazole-4-carboxamide
Basic Information
CAS
1228280-29-2
Multi CAS
No
Molecular Formula
C18H16N4O2S
Molecular Weight
352.400000
Exact Mass
352.099397
SMILES
CC1=CC=C(C=C1)C(=O)NC2=C(N=C(S2)NC3=CC=CC=C3)C(=O)N
InChI
InChI=1S/C18H16N4O2S/c1-11-7-9-12(10-8-11)16(24)22-17-14(15(19)23)21-18(25-17)20-13-5-3-2-4-6-13/h2-10H,1H3,(H2,19,23)(H,20,21)(H,22,24)
InChIKey
WCEDGRTWDSHZHF-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
17
Fraction Csp3
0.06
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
3
Molar refractivity
99.49
TPSA
97.11
LogP / Solubility
WLOGP
3.55
MLOGP
3.14
XLogP3
4.1
Consensus LogP
3.6
Log S (ESOL)
-4.43
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.01
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.49
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)
-2.35
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
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