AC1MSHM2
4-[[2,2,2-trichloro-1-[(2-phenylacetyl)amino]ethyl]carbamothioylamino]benzoic acid
Also Known As: CBDivE_002760|4-[({2,2,2-trichloro-1-[(phenylacetyl)amino]ethyl}carbamothioyl)amino]benzoic acid|4-(3-(2,2,2-trichloro-1-(2-phenylacetamido)ethyl)thioureido)benzoic acid|4((((2,2,2-TRI-CL-1-((PHENYLACETYL)AMINO)ET)AMINO)CARBOTHIOYL)AMINO)BENZOIC ACID|4-({[2,2,2-TRICHLORO-1-(2-PHENYLACETAMIDO)ETHYL]CARBAMOTHIOYL}AMINO)BENZOIC ACID|4-[[2,2,2-trichloro-1-[(2-phenylacetyl)amino]ethyl]carbamothioylamino]benzoic acid|4-{[({2,2,2-trichloro-1-[(phenylacetyl)amino]ethyl}amino)carbonothioyl]amino}benzoic acid
| Molecular Formula | C18H16Cl3N3O3S |
|---|---|
| Molecular Weight | 458.9978 g/mol |
| LogP | 3.7264 |
| Topological Polar Surface Area | 90.46 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.9978 |
| Monoisotopic Mass | 458.9978 |
| Heavy Atoms | 28 |
| Complexity | 842.6495 |
Chemical Identifiers
| CAS Number | 294658-22-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)C(=O)O |
Product Overview
AC1MSHM2 (CAS 294658-22-3), with molecular formula C18H16Cl3N3O3S and molecular weight 458.9978 g/mol. IUPAC: 4-[[2,2,2-trichloro-1-[(2-phenylacetyl)amino]ethyl]carbamothioylamino]benzoic acid.
AC1MSHM2 is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »