CAS RN: 301305-73-7
TCS 359
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.20260627 | 25mg / 100mg / 250mg | Confirm by inquiry | Shanghai | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260216 | 100mg | In stock | Shanghai | Inquiry |
| Batchno.20260520 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20250607 | 1g | Out of stock | Inquiry | |
| Batchno.20250421 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20250121 | 250mg | In stock | Shanghai | Inquiry |
| Batchno.20251116 | 50mg | In stock | Shanghai | Inquiry |
| Batchno.20250924 | 5mg | In stock | Shanghai | Inquiry |
- Product code: ICTD5275
- Purity/Analytical Methods: >98.0%(HPLC)
301305-73-7 / 2-[(3,4-dimethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Basic Information
CAS
301305-73-7
Multi CAS
Yes
Molecular Formula
C18H20N2O4S
Molecular Weight
360.400000
Exact Mass
360.114378
InChI
InChI=1S/C18H20N2O4S/c1-23-12-8-7-10(9-13(12)24-2)17(22)20-18-15(16(19)21)11-5-3-4-6-14(11)25-18/h7-9H,3-6H2,1-2H3,(H2,19,21)(H,20,22)
InChIKey
FSPQCTGGIANIJZ-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
25
Aromatic heavy atom count
11
Fraction Csp3
0.33
Rotatable bonds
5
H-bond acceptors
5
H-bond donors
2
Molar refractivity
96.98
TPSA
90.65
LogP / Solubility
WLOGP
3
MLOGP
2.66
XLogP3
3.4
Consensus LogP
3.02
Log S (ESOL)
-3.96
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.68
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.09
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)
-2.79
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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