| CAS Number | 1421448-26-1 |
| Catalog Number | AG01E216 |
| Chemical Name | GN44028 |
| IUPAC Name | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,4-dihydroindeno[1,2-c]pyrazol-3-amine |
| InChI | InChI=1S/C18H15N3O2/c1-2-4-13-11(3-1)9-14-17(13)20-21-18(14)19-12-5-6-15-16(10-12)23-8-7-22-15/h1-6,10H,7-9H2,(H2,19,20,21) |
| InChI Key | CGZKSZVSWAAUHE-UHFFFAOYSA-N |
| MDL Number | MFCD30182340 |
| Molecular Formula | C18H15N3O2 |
| Molecular Weight | 305.3306 |
| SMILES | C12=CC=CC=C1C3=C(C2)C(NC4=CC5=C(C=C4)OCCO5)=NN3 |
| Synonyms | CHEMBL2323956,
GN44028,
1421448-26-1,
BDBM50426548,
ZINC95582279,
AKOS027470243,
GN 44028,
GN-44028,
HY-110266,
CS-0033132,
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,4-dihydroindeno[1,2-c]pyrazol-3-amine,
N-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-1,4-dihydroindeno[1,2-c]pyrazol-3-amine,
CGZKSZVSWAAUHE-UHFFFAOYSA-N,
|
| Complexity | 435 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.116427g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 305.3g/mol |
| Monoisotopic Mass | 305.116427g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 59.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number