4-(1-benzofuran-2-carbonyl)-5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one
Structure Info
- Chemspace ID
- CSSB00121727053 (In-Stock Building Blocks)
- MFCD
- MFCD04148018
- IUPAC Name
- 4-(1-benzofuran-2-carbonyl)-5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one
- Mol formula
- C31H25N3O6S2
- Mol weight
- 600 Da
- Catalog Number(s)
- 1681367, AA02VLJA, AF-399/42018997, BW33378, CSC121727053, CUS57962782, OSSK_415270, ST02VN2U, STK800314, TX02VMRQ
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.79
- Heavy atoms count
- 42
- Rotatable bond count
- 9
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.161
- Polar surface area (Å)
- 126
- Hydrogen bond acceptors count
- 7
- Hydrogen bond donors count
- 2
![Chemical structure of 4-(1-benzofuran-2-carbonyl)-5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-1-(5-{[(4-methylphenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2,5-dihydro-1H-pyrrol-2-one (C31H25N3O6S2) - CSSB00121727053](/st/structure/200/1d2ba7f11a154899c89fad9d9ca654e8/CCOC1%253DCC%2528%253DCC%253DC1O%2529C1N%2528C%2528%253DO%2529C%2528O%2529%253DC1C%2528%253DO%2529C1%253DCC2%253DCC%253DCC%253DC2O1%2529C1%253DNN%253DC%2528SCC2%253DCC%253DC%2528C%2529C%253DC2%2529S1.png "C31H25N3O6S2")
- Zoom the structure
- CSSB00121727053
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-benzofuran-2-carbonyl)-2-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-1-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2H-pyrrol-5-one; CAS: 618865-09-1 | ||||||
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