AC1NRPEO
ethyl 4-[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]carbamoyl]amino]benzoate
Also Known As: ETHYL 4-[[BUTYL-[[(4-FLUOROPHENYL)METHYL-[(4-OXOCHROMEN-3-YL)METHYL]CARBAMOYL]METHYL]CARBAMOYL]AMINO]BENZOATE|ethyl 4-[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]carbamoyl]amino]benzoate|Ethyl 4-{[butyl(2-{[(4-fluorophenyl)methyl][(4-oxo-4H-1-benzopyran-3-yl)methyl]amino}-2-oxoethyl)carbamoyl]amino}benzoate|ETHYL 4-{[BUTYL({[(4-FLUOROPHENYL)METHYL][(4-OXO-4H-CHROMEN-3-YL)METHYL]CARBAMOYL}METHYL)CARBAMOYL]AMINO}BENZOATE
| Molecular Formula | C33H34FN3O6 |
|---|---|
| Molecular Weight | 587.24316 g/mol |
| LogP | 5.9718 |
| Topological Polar Surface Area | 109.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 587.24316 |
| Monoisotopic Mass | 587.24316 |
| Heavy Atoms | 43 |
| Complexity | 1618.7731 |
Chemical Identifiers
| CAS Number | 5972-89-4 |
|---|---|
| SMILES | CCCCN(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)NC4=CC=C(C=C4)C(=O)OCC |
Product Overview
AC1NRPEO (CAS 5972-89-4), with molecular formula C33H34FN3O6 and molecular weight 587.24316 g/mol. IUPAC: ethyl 4-[[butyl-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]carbamoyl]amino]benzoate.