VUFB-14128
2-[4-[2-[8-fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-2-oxoethyl]piperazin-1-yl]ethyl propanoate;dihydrochloride
| Molecular Formula | C27H35Cl2F2N3O3 |
|---|---|
| Molecular Weight | 558.5 g/mol |
| Topological Polar Surface Area | 53.1 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 557.20233 |
| Heavy Atoms | 37 |
| Complexity | 695.0 |
Chemical Identifiers
| CAS Number | 77796-05-5 |
|---|---|
| SMILES | CCC(=O)OCCN1CCN(CC1)CC(=O)N2CCCC(C3=C2C=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl |
| InChIKey | FNMWGXYUFKOZRQ-UHFFFAOYSA-N |
📖 Product Overview
VUFB-14128 (CAS: 77796-05-5) is a chemical compound with molecular formula C27H35Cl2F2N3O3 and molecular weight 558.5 g/mol. Its IUPAC systematic name is 2-[4-[2-[8-fluoro-5-(4-fluorophenyl)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]-2-oxoethyl]piperazin-1-yl]ethyl propanoate;dihydrochloride.
FNMWGXYUFKOZRQ-UHFFFAOYSA-N.
SMILES: CCC(=O)OCCN1CCN(CC1)CC(=O)N2CCCC(C3=C2C=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl.
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