CAS RN: 1672691-74-5
4-(4-Morpholinyl)-1,2,5-thiadiazol-3-yl N-cyclooctyl-N-methylcarbamate
Product Availability
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13 package records11 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260512 | 1mg / 10mg / 25mg / 100mg / 250mg | Out of stock | 15 business days | Inquiry |
| Batch No. | Package | Availability | Warehouse | Lead Time | Inquiry |
|---|---|---|---|---|---|
| Batchno.20260407 | 100mg | In stock | Shanghai | Inquiry | |
| Batchno.20260411 | 10mg | In stock | Shanghai | Inquiry | |
| Batchno.20260317 | 1mg | In stock | Shanghai | Inquiry | |
| Batchno.20251118 | 250mg | In stock | Shanghai | Inquiry | |
| Batchno.20250923 | 25mg | In stock | Shanghai | Inquiry | |
| Batchno.20251026 | 50mg | In stock | Shanghai | Inquiry | |
| Batchno.20251112 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1672691-74-5
- Purity/Analytical Methods: >99.0%
1672691-74-5 / (4-morpholin-4-yl-1,2,5-thiadiazol-3-yl) N-cyclooctyl-N-methylcarbamate
Basic Information
CAS
1672691-74-5
Multi CAS
No
Molecular Formula
C16H26N4O3S
Molecular Weight
354.500000
Exact Mass
354.172562
SMILES
CN(C1CCCCCCC1)C(=O)OC2=NSN=C2N3CCOCC3
InChI
InChI=1S/C16H26N4O3S/c1-19(13-7-5-3-2-4-6-8-13)16(21)23-15-14(17-24-18-15)20-9-11-22-12-10-20/h13H,2-12H2,1H3
InChIKey
WKSHMJCYWFOADB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
5
Fraction Csp3
0.81
Rotatable bonds
3
H-bond acceptors
7
Molar refractivity
92.84
TPSA
67.79
LogP / Solubility
WLOGP
2.92
MLOGP
2.59
XLogP3
3.4
Consensus LogP
2.97
Log S (ESOL)
-3.83
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.57
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.75
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.81
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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