2-(hydroxymethyl)-1-[(E)-[(5-nitro-2-oxidophenyl)methylidene]amino]-1H-1,3-benzodiazol-3-ium
Structure Info
- Chemspace ID
- CSSB00160807401 (In-Stock Building Blocks)
- MFCD
- MFCD01238829
- IUPAC Name
- 2-(hydroxymethyl)-1-[(E)-[(5-nitro-2-oxidophenyl)methylidene]amino]-1H-1,3-benzodiazol-3-ium
- Mol formula
- C15H12N4O4
- Mol weight
- 312 Da
- Catalog Number(s)
- AA0316EO, AE-848/36959099, BY93708, CSC160807401, CSC161054874, LN00665043, ST0317Y8, STL040715, STOCK4S-27695, TX0317N4
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.67
- Heavy atoms count
- 23
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.066
- Polar surface area (Å)
- 118
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
![Chemical structure of 2-(hydroxymethyl)-1-[(E)-[(5-nitro-2-oxidophenyl)methylidene]amino]-1H-1,3-benzodiazol-3-ium (C15H12N4O4) - CSSB00160807401](/st/structure/200/2004e991ab964e0bf1938df8de2362e7/OCC1%253D%255BNH%252B%255DC2%253DCC%253DCC%253DC2N1%255CN%253DC%255CC1%253DCC%2528%253DCC%253DC1%255BO-%255D%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO.png "C15H12N4O4")
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- CSSB00160807401
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: (E)-2-(((2-(hydroxymethyl)-1H-benzo[d]imidazol-1-yl)imino)methyl)-4-nitrophenol; CAS: 342398-16-7 | ||||||
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