5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol
Structure Info
- Chemspace ID
- CSSB00000010816 (In-Stock Building Blocks)
- CAS
- 757220-77-2
- MFCD
- MFCD06342762
- IUPAC Name
- 5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol
- Mol formula
- C9H7FN2S3
- Mol weight
- 258 Da
- Catalog Number(s)
- A1011000, AA019JKJ, AG019JNB, BBV-38778064, BBV-395848186, BD00974617, CSC000010816, EN300-09903, F591248, HFB22077, ST019L43, TX019KSZ, Y4017264, Z57000524
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.6
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.11111111111111
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
![Chemical structure of 5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol (C9H7FN2S3) - CSSB00000010816](/st/structure/200/e4ebc4911fa5fae75ca0594b607a9d19/FC1%253DCC%253DC%2528CSC2%253DNN%253DC%2528S%2529S2%2529C%253DC1.png "C9H7FN2S3")
- Zoom the structure
- CSSB00000010816
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 42.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 66.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 92.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 175.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 256.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 503.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 743.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 1,101.00 |
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Substructure Analogs
![Chemical structure of N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide - CSSB00025764042](/st/structure/200/1301fd9e329a584f00dca473fb7e5ab2/FC1%253DCC%253DC%2528CSC2%253DNN%253DC%2528SCC%2528%253DO%2529NC3%253DCC%2528%253DCC%253DC3Cl%2529C%2528F%2529%2528F%2529F%2529S2%2529C%253DC1.png)
Similarity Analogs
![Chemical structure of 5-{[(4-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol - CSSB00000010567](/st/structure/200/1c4f4f584fbc5c847885c9e3ab3ef38e/SC1%253DNN%253DC%2528SCC2%253DCC%253DC%2528Cl%2529C%253DC2%2529S1.png)
![Chemical structure of 5-({[4-(propan-2-yl)phenyl]methyl}sulfanyl)-1,3,4-thiadiazole-2-thiol - CSSB00000689700](/st/structure/200/461adbe740dd2f4bf50d87f17c67e7f3/CC%2528C%2529C1%253DCC%253DC%2528CSC2%253DNN%253DC%2528S%2529S2%2529C%253DC1.png)
![Chemical structure of 5-{[(4-methoxyphenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol - CSSB00000010929](/st/structure/200/a7dcc5d248b044c2d7d514fbf49cc40b/COC1%253DCC%253DC%2528CSC2%253DNN%253DC%2528S%2529S2%2529C%253DC1.png)
![Chemical structure of 5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine - CSSB00000149056](/st/structure/200/d697f6eefe96416b3babe3dc94fdcaae/NC1%253DNN%253DC%2528SCC2%253DCC%253DC%2528F%2529C%253DC2%2529S1.png)
![Chemical structure of 2-{[(4-fluorophenyl)methyl]sulfanyl}-5-methyl-1,3,4-thiadiazole - CSSB00000001092](/st/structure/200/8db11accb0c935793fecf85e6f4519a9/CC1%253DNN%253DC%2528SCC2%253DCC%253DC%2528F%2529C%253DC2%2529S1.png)
![Chemical structure of 5-{[(3-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol - CSSB00010005775](/st/structure/200/0f2de5a090ef23f7278f4fafdb387eb0/SC1%253DNN%253DC%2528SCC2%253DCC%253DCC%2528Cl%2529%253DC2%2529S1.png)
