CAS RN: 1334921-03-7
TAI-1
Product Availability
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9 package records6 with current stock2 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250429 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20250302 | 100mg | Out of stock | Inquiry | ||
| Batchno.20250918 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20251210 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20250520 | 250mg | Out of stock | Inquiry | ||
| Batchno.20260606 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20250209 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20250510 | 5mg | In stock | Shanghai | Inquiry | |
| Batchno.20260313 | 5mg / 25mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS1334921-03-7
- Purity/Analytical Methods: >99.0%
1334921-03-7 / N-[4-[4-(4-methoxyphenoxy)-2,6-dimethylphenyl]-1,3-thiazol-2-yl]pyridine-4-carboxamide
Basic Information
CAS
1334921-03-7
Multi CAS
No
Molecular Formula
C24H21N3O3S
Molecular Weight
431.500000
Exact Mass
431.130363
SMILES
CC1=CC(=CC(=C1C2=CSC(=N2)NC(=O)C3=CC=NC=C3)C)OC4=CC=C(C=C4)OC
InChI
InChI=1S/C24H21N3O3S/c1-15-12-20(30-19-6-4-18(29-3)5-7-19)13-16(2)22(15)21-14-31-24(26-21)27-23(28)17-8-10-25-11-9-17/h4-14H,1-3H3,(H,26,27,28)
InChIKey
NBNNDUZYMXBCOX-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
31
Aromatic heavy atom count
23
Fraction Csp3
0.12
Rotatable bonds
6
H-bond acceptors
6
H-bond donors
1
Molar refractivity
122.28
TPSA
73.34
LogP / Solubility
WLOGP
5.88
MLOGP
5.2
XLogP3
4.9
Consensus LogP
5.33
Log S (ESOL)
-6.37
Class (ESOL)
Insoluble
Log S (Ali)
-7.34
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.06
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.18
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3
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