4-methyl-5-[2-(3-methyladamantane-1-carbonyloxy)ethyl]-3-[(4-nitrophenyl)methyl]-1,3-thiazol-3-ium
Structure Info
- Chemspace ID
- CSSB00121706086 (In-Stock Building Blocks)
- MFCD
- MFCD02227228
- IUPAC Name
- 4-methyl-5-[2-(3-methyladamantane-1-carbonyloxy)ethyl]-3-[(4-nitrophenyl)methyl]-1,3-thiazol-3-ium
- Mol formula
- C25H31N2O4S
- Mol weight
- 456 Da
- Catalog Number(s)
- AA01OPA7, AG-690/15431829, BC32027, CSC121706086, ST01OQTR, TX01OQIN
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.93
- Heavy atoms count
- 32
- Rotatable bond count
- 8
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.6
- Polar surface area (Å)
- 73
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
![Chemical structure of 4-methyl-5-[2-(3-methyladamantane-1-carbonyloxy)ethyl]-3-[(4-nitrophenyl)methyl]-1,3-thiazol-3-ium (C25H31N2O4S) - CSSB00121706086](/st/structure/200/113789847d7491c052bbd2645436a6d8/CC1%253DC%2528CCOC%2528%253DO%2529C23CC4CC%2528CC%2528C%2529%2528C4%2529C2%2529C3%2529SC%253D%255BN%252B%255D1CC1%253DCC%253DC%2528C%253DC1%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO.png "C25H31N2O4S")
- Zoom the structure
- CSSB00121706086
Items Overall 1 item 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 | |
Description: 4-Methyl-5-[2-[[(3-methyltricyclo[3.3.1.13,7]dec-1-yl)carbonyl]oxy]ethyl]-3-[(4-nitrophenyl)methyl]thiazolium; CAS: 751475-56-6 | ||||||
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