Basic information
- CAS
1170783-75-1- Standard SMILES
CCC(NC(=O)CCCN(c1cc(Cl)ccc1Cl)S(C)(=O)=O)c1ccc(C)cc1- InChIKey
BBUSHQIOJNIQPR-UHFFFAOYSA-N- Molecular formula
- C21H26Cl2N2O3S
- Average molar mass
- 457.4 g/mol
- Monoisotopic mass
- 456.1041193
Names & identifiers
- Preferred name
- 4-[(2,5-Dichlorophenyl)(methylsulfonyl)amino]-N-[1-(4-methylphenyl)propyl]butanamide
- IUPAC
- 4-(2,5-dichloro-N-methylsulfonylanilino)-N-[1-(4-methylphenyl)propyl]butanamide
Names & synonyms
DTXSID5011289454-[(2,5-Dichlorophenyl)(methylsulfonyl)amino]-N-[1-(4-methylphenyl)propyl]butanamide1170783-75-14-[(2,5-Dichlorophenyl)(methanesulfonyl)amino]-N-[1-(4-methylphenyl)propyl]butanamide
Database identifiers
- CAS
1170783-75-1- PubChem CID
- 43915744
- DTXSID
DTXSID501128945
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 618
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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