| CAS Number | 1541200-53-6 |
| Catalog Number | AG00IMK3(AGN-PC-0WQUOQ) |
| Chemical Name | 5-Phenyl-5H-pyrido[3,2-b]indole |
| IUPAC Name | 5-phenylpyrido[3,2-b]indole |
| InChI | InChI=1S/C17H12N2/c1-2-7-13(8-3-1)19-15-10-5-4-9-14(15)17-16(19)11-6-12-18-17/h1-12H |
| InChI Key | NGQWQTGGMORPSA-UHFFFAOYSA-N |
| MDL Number | MFCD31618152 |
| Molecular Formula | C17H12N2 |
| Molecular Weight | 244.2906 |
| SMILES | C1=CC=C(C=C1)N2C3=C(C4=CC=CC=C42)N=CC=C3 |
| Synonyms | 5-Phenyl-5H-pyrido[3,2-b]indole,
1541200-53-6,
9-Phenyl-delta-carboline,
SCHEMBL12396559,
P2578,
|
| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.297g/mol |
| Monoisotopic Mass | 244.1g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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Certificate of Analysis
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