| CAS Number | 335161-27-8 |
| Catalog Number | AG00C6PC(AGN-PC-0WOI0K) |
| Chemical Name | AM-1235 |
| IUPAC Name | [1-(5-fluoropentyl)-6-nitroindol-3-yl]-naphthalen-1-ylmethanone |
| InChI | InChI=1S/C24H21FN2O3/c25-13-4-1-5-14-26-16-22(20-12-11-18(27(29)30)15-23(20)26)24(28)21-10-6-8-17-7-2-3-9-19(17)21/h2-3,6-12,15-16H,1,4-5,13-14H2 |
| InChI Key | LNGVQORPSNNMSZ-UHFFFAOYSA-N |
| MDL Number | MFCD28143338 |
| Molecular Formula | C24H21FN2O3 |
| Molecular Weight | 404.4335 |
| SMILES | O=C(C1=CC=CC=2C=CC=CC21)C3=CN(C=4C=C(C=CC34)N(=O)=O)CCCCCF |
| UNII | 2HV9AH611M |
| Synonyms | 335161-27-8,
UNII-2HV9AH611M,
AM-1235,
AM 1235,
2HV9AH611M,
LNGVQORPSNNMSZ-UHFFFAOYSA-N,
SCHEMBL16346922,
(1-(5-Fluoropentyl)-3-(naphthalen-1-oyl)-6-nitroindole),
DTXSID10187159,
ZINC95705003,
(1-(5-fluoropentyl)-6-nitro-1H-indol-3-yl)(naphthalen-1-yl)Methanone,
AM1235,
[1-(5-fluoropentyl)-6-nitroindol-3-yl]-naphthalen-1-ylmethan,
|
| Complexity | 610 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 404.154g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 30 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 404.441g/mol |
| Monoisotopic Mass | 404.154g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 67.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number