CAS RN: 259810-12-3
6,7-DIHYDRO-4H-PYRANO[4,3-D]THIAZOL-2-YLAMINE
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Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.
- Pack sizes on record: 1g, 5g, 0.25g, 10g, 25g
- Available purity: >95%
- Inventory rows with stock: 4
- Bulk packaging: confirmed by inquiry
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Recorded sizes, purity and stock details for CAS 259810-12-3
| Pack Size |
Recorded Purity |
Available Qty |
Ship From |
Inquiry |
| 1g |
>95% |
4
In Stock
|
Shenzhen |
Inquiry |
| 5g |
>95% |
4
In Stock
|
Shanghai |
Inquiry |
| 0.25g |
>95% |
2
In Stock
|
Shanghai |
Inquiry |
| 10g |
>95% |
1
In Stock
|
Shanghai |
Inquiry |
| 25g |
>95% |
0
Out of Stock
|
Hong Kong |
Inquiry |
259810-12-3 / 6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-amine
Standard CAS: 259810-12-3
Multi CAS: No
Basic Information
CAS
259810-12-3
Multi CAS
No
Molecular Formula
C6H8N2OS
Molecular Weight
156.210000
Exact Mass
156.035734
SMILES
C1COCC2=C1N=C(S2)N
InChI
InChI=1S/C6H8N2OS/c7-6-8-4-1-2-9-3-5(4)10-6/h1-3H2,(H2,7,8)
InChIKey
HEBMTQWTUCFOEB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
5
Fraction Csp3
0.5
H-bond acceptors
4
H-bond donors
1
Molar refractivity
39.89
TPSA
48.14
LogP / Solubility
WLOGP
0.8
MLOGP
0.7
XLogP3
0.4
Consensus LogP
0.63
Log S (ESOL)
-1.68
Class (ESOL)
Soluble
Log S (Ali)
-1.42
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.34
Class (SILICOS-IT)
Soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.11
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5