1-{[6-(2,4-dichlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}azepane
Structure Info
- Chemspace ID
- CSSB00121609144 (In-Stock Building Blocks)
- MFCD
- MFCD18067900
- IUPAC Name
- 1-{[6-(2,4-dichlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}azepane
- Mol formula
- C16H17Cl2N5S
- Mol weight
- 382 Da
- Catalog Number(s)
- AA029FOM, AO-365/43463277, BL99362, CSC121609144, IB06-2546, OSSL_451174, ST029H86, STL086144, STOCK7S-07551, TX029GX2
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.36
- Heavy atoms count
- 24
- Rotatable bond count
- 3
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.437
- Polar surface area (Å)
- 46
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
![Chemical structure of 1-{[6-(2,4-dichlorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}azepane (C16H17Cl2N5S) - CSSB00121609144](/st/structure/200/93491211b0b571db407a8d75609511c9/ClC1%253DCC%253DC%2528C2%253DNN3C%2528CN4CCCCCC4%2529%253DNN%253DC3S2%2529C%2528Cl%2529%253DC1.png "C16H17Cl2N5S")
- Zoom the structure
- CSSB00121609144
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)-6-(2,4-dichlorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole; CAS: 1246057-13-5 | ||||||
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