Hydrocinnamanilide, 3'-amidino-alpha-(p-toluenesulfonamido)-
Basic information
- CAS
92953-68-9- Standard SMILES
Cc1ccc(S(=O)(=O)NC(Cc2ccccc2)C(=O)Nc2cccc(C(=N)N)c2)cc1- InChIKey
WPCPYIPHLGNKHP-UHFFFAOYSA-N- Molecular formula
- C23H24N4O3S
- Average molar mass
- 436.5 g/mol
- Monoisotopic mass
- 436.15691181
Names & identifiers
- Preferred name
- Hydrocinnamanilide, 3'-amidino-alpha-(p-toluenesulfonamido)-
- IUPAC
- N-(3-carbamimidoylphenyl)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide
Names & synonyms
3'-Amidino-alpha-(p-toluenesulfonamido)hydrocinnamanilide92953-68-9Hydrocinnamanilide, 3'-amidino-alpha-(p-toluenesulfonamido)-Benzenepropanamide, N-(3-(aminoiminoethyl)phenyl)-alpha-(((4-methylphenyl)sulfonyl)amino)-RefChem:348300DTXSID10918849N-(3-Carbamimidoylphenyl)-2-(4-methylbenzene-1-sulfonamido)-3-phenylpropanimidic acidN-(3-Carbamimidoylphenyl)-2-[(4-methylbenzene-1-sulfonyl)amino]-3-phenylpropanimidic acid
Database identifiers
- CAS
92953-68-9- PubChem CID
- 64919
- DTXSID
DTXSID10918849
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 707
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Compound notes
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