| CAS Number | 2070015-13-1 |
| Catalog Number | AG01EOOU(AGN-PC-3H4IA0) |
| Chemical Name | N-Benzyl-2-(2,3-dihydro-4H-benzo[b][1,4]oxazin-4-yl)-5,6,7,8-tetrahydroquinazolin-4-amine hydrochloride |
| IUPAC Name | N-benzyl-2-(2,3-dihydro-1,4-benzoxazin-4-yl)-5,6,7,8-tetrahydroquinazolin-4-amine;hydrochloride |
| InChI | InChI=1S/C23H24N4O.ClH/c1-2-8-17(9-3-1)16-24-22-18-10-4-5-11-19(18)25-23(26-22)27-14-15-28-21-13-7-6-12-20(21)27;/h1-3,6-9,12-13H,4-5,10-11,14-16H2,(H,24,25,26);1H |
| InChI Key | DYHMHNNBOLCULH-UHFFFAOYSA-N |
| MDL Number | MFCD30187511 |
| Molecular Formula | C23H25ClN4O |
| Molecular Weight | 408.9238 |
| SMILES | Cl.N=1C(=NC2=C(C1NCC=3C=CC=CC3)CCCC2)N4C=5C=CC=CC5OCC4 |
| Synonyms | ML241 hydrochloride,
ML241 (hydrochloride),
2070015-13-1,
ML241 HCl,
HY-19797A,
AKOS032944934,
CS-5575,
2070015-13-1 (HCl),
|
| Complexity | 497 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 408.171689g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 408.9g/mol |
| Monoisotopic Mass | 408.171689g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 50.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number