5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol
Structure Info
- Chemspace ID
- CSSB00000010552 (In-Stock Building Blocks)
- CAS
- 345991-75-5
- MFCD
- MFCD02029641, MFCD28390680
- IUPAC Name
- 5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol
- Mol formula
- C9H7ClN2S3
- Mol weight
- 275 Da
- Catalog Number(s)
- 345991-75-5, 6981786, A019139738, AA00C0GJ, ACM345991755, AF60367, AG00C0JB, AG223306, BBV-45055056, BBV-91096013, BD100647, CD11139172, CS-0366836, CSC000010552, CSC135448923, FCH1672882, FCH7178309, HY-W326386, IBS-L0037853, JH266512, LN01821985, OSSL_301431, PB57016643, TX00C1OZ, Y3530827, Z56939175
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.06
- 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-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol (C9H7ClN2S3) - CSSB00000010552](/st/structure/200/db6689e5bfc5e87b74e57a89ed9709cf/SC1%253DNN%253DC%2528SCC2%253DCC%253DCC%253DC2Cl%2529S1.png "C9H7ClN2S3")
- Zoom the structure
- CSSB00000010552
Items Overall 2 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| AA Blocks CN | 12 days | China To: | 90 | 1 mg | 107.80 | |
| AA Blocks CN | 12 days | China To: | 90 | 5 mg | 150.70 | |
Description: 5-((2-Chlorobenzyl)thio)-1,3,4-thiadiazole-2-thiol; CAS: 345991-75-5 | ||||||
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Substructure Analogs
![Chemical structure of 5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol - CSSB00000010897](/st/structure/200/f744cdebfc4ae9219954ecdb374bdf9d/SC1%253DNN%253DC%2528SCC2%253DC%2528Cl%2529C%253DCC%253DC2Cl%2529S1.png)
![Chemical structure of 5-{[(2,4-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol - CSSB00010005776](/st/structure/200/6cbc57320bbbe2d5b1c148736f7942de/SC1%253DNN%253DC%2528SCC2%253DCC%253DC%2528Cl%2529C%253DC2Cl%2529S1.png)
![Chemical structure of 2-[(5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]acetohydrazide - CSSB00000689574](/st/structure/200/af33260b5d52d29df2534d412bcd08b5/NNC%2528%253DO%2529CSC1%253DNN%253DC%2528SCC2%253DCC%253DCC%253DC2Cl%2529S1.png)
Similarity Analogs
![Chemical structure of 5-{[(2-chlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine - CSSB00000149055](/st/structure/200/9fa91de08d782461a6d9375307ed8be6/NC1%253DNN%253DC%2528SCC2%253DCC%253DCC%253DC2Cl%2529S1.png)
![Chemical structure of 5-{[(naphthalen-1-yl)methyl]sulfanyl}-1,3,4-thiadiazole-2-thiol - CSSB00000683027](/st/structure/200/50ce59c2ce332e8955be32e37a3af0cc/SC1%253DNN%253DC%2528SCC2%253DCC%253DCC3%253DCC%253DCC%253DC23%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)
![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)
