| CAS Number | 372144-23-5 |
| Catalog Number | AG01BVN0 |
| Chemical Name | 3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(pyridin-4-yl)propanoic acid |
| IUPAC Name | 3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-pyridin-4-ylpropanoic acid |
| InChI | InChI=1S/C23H20N2O4/c26-22(27)13-21(15-9-11-24-12-10-15)25-23(28)29-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-12,20-21H,13-14H2,(H,25,28)(H,26,27) |
| InChI Key | ZWVPLGLFWZWAMY-UHFFFAOYSA-N |
| MDL Number | MFCD03425254 |
| Molecular Formula | C23H20N2O4 |
| Molecular Weight | 388.4159 |
| SMILES | OC(CC(C1=CC=NC=C1)NC(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)=O |
| Synonyms | 372144-23-5,
3-(9H-Fluoren-9-ylmethoxycarbonylamino)-3-pyridin-4-yl-propionic acid,
3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(pyridin-4-yl)propanoic acid,
3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(pyridin-4-yl)propanoic acid,
CTK7G4134,
ZX-AV000794,
AKOS027445424,
BBV-38260345,
3-([(9h-fluoren-9-ylmethoxy)carbonyl]amino)-3-pyridin-4-ylpropanoic acid,
3-(9 h-fluoren-9-ylmethoxycarbonylamino)-3-pyridin-4-yl-propionic acid,
3-(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-pyridin-4-ylpropanoic acid,
|
| Complexity | 555 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 388.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 388.423g/mol |
| Monoisotopic Mass | 388.142g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 88.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number