CBMicro_046673
3-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: CBMicro_046673|Oprea1_629828|BIM-0046621.P001|AK-968/41018274|2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-3-carboxylic acid|3-({[5-(ETHYLSULFANYL)-1,3,4-THIADIAZOL-2-YL]AMINO}CARBONYL)BICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID|3-{[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid|3-({[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino}carbonyl)bicyclo[2.2.1]heptane-2-carboxylic acid|3-[N-(5-ethylthio-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-2-carb oxylic acid
| Molecular Formula | C13H17N3O3S2 |
|---|---|
| Molecular Weight | 327.07114 g/mol |
| LogP | 2.3355 |
| Topological Polar Surface Area | 92.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.07114 |
| Monoisotopic Mass | 327.07114 |
| Heavy Atoms | 21 |
| Complexity | 562.6113 |
Chemical Identifiers
| CAS Number | 345347-69-5 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)C2C3CCC(C3)C2C(=O)O |
Product Overview
CBMicro_046673 (CAS 345347-69-5), with molecular formula C13H17N3O3S2 and molecular weight 327.07114 g/mol. IUPAC: 3-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]bicyclo[2.2.1]heptane-2-carboxylic acid.
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