Trimethoprim sulfamethizole
Basic information
- CAS
79735-35-6- Standard SMILES
COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC.Cc1nnc(NS(=O)(=O)c2ccc(N)cc2)s1- InChIKey
ZKSSBLPBDVQKCH-UHFFFAOYSA-N- Molecular formula
- C23H28N8O5S2
- Average molar mass
- 560.7 g/mol
- Monoisotopic mass
- 560.16240837
Names & identifiers
- Preferred name
- Trimethoprim sulfamethizole
- IUPAC
- 4-amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide;5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine
- English name
- trimethoprim sulfamethizole
- Molecular formula
- C23H28N8O5S2
- Molecular weight
- 560.64902
Names & synonyms
79735-35-6Trimethoprim sulfamethizoleDTXSID902298494-amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide;5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamineBenzenesulfonamide, 4-amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)-, mixt. with 5-((3,4,5-trimethoxyphenyl)methyl)-2,4-pyrimidinediamine4-Amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzene-1-sulfonamide--5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diamine (1/1)
Database identifiers
- CAS
79735-35-6- PubChem CID
- 64931
- DTXSID
DTXSID90229849
Properties
Computed structural properties
- Topological polar surface area
- 240 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 8
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 655
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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