1-({6-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)azepane
Structure Info
- Chemspace ID
- CSSB00121607952 (In-Stock Building Blocks)
- MFCD
- MFCD18066798
- IUPAC Name
- 1-({6-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)azepane
- Mol formula
- C17H20ClN5OS
- Mol weight
- 378 Da
- Catalog Number(s)
- 9200616, AA029FJF, AO-365/43463317, BL99175, CSC121607952, IB05-9190, LN00861830, OSSL_451197, ST029H2Z, STL086167, STOCK7S-05964, TX029GRV
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.38
- Heavy atoms count
- 25
- Rotatable bond count
- 5
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.47
- Polar surface area (Å)
- 56
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 0
![Chemical structure of 1-({6-[(4-chlorophenoxy)methyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl}methyl)azepane (C17H20ClN5OS) - CSSB00121607952](/st/structure/200/164a1ed3a2f3d7d42ea9d9eeea7a5415/ClC1%253DCC%253DC%2528OCC2%253DNN3C%2528CN4CCCCCC4%2529%253DNN%253DC3S2%2529C%253DC1.png "C17H20ClN5OS")
- Zoom the structure
- CSSB00121607952
Items Overall 3 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 90 | 10 mg | 245.30 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 50 mg | 288.20 | |
| 1st Scientific LLC | 14 days | United States To: | 90 | 100 mg | 317.90 | |
Description: [3-(1-azepanylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]methyl 4-chlorophenyl ether; CAS: 1246075-90-0 | ||||||
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