2,4-Dimethyl-3H-1,5-benzodiazepine
2,4-dimethyl-3H-1,5-benzodiazepine
Also Known As: 2,4-Dimethyl-3H-1,5-benzodiazepine|NCIOpen2_007238|CBDivE_012462|3H-1,5-Benzodiazepine, 2,4-dimethyl-|2,4-Dimethyl-3H-benzo[b][1,4]diazepine|2,4aDimethyla3Ha1,5abenzodiazepine|2,4-Dimethyl-1H-1,5-benzodiazepine|2,4-Dimethyl-3H-1,5-benzodiazepine #|2,4-dimethyl-3H-benzo[b]1,4-diazepine|BAS 00400262|AE-508/36399008|(1Z,4Z)-2,4-dimethyl-3H-benzo[b][1,4]diazepine|A0816/0038214|Pyrimido[1,2-a]indole,6,7,8,9-tetrahydro-2,4-dimethyl|3,5-dimethyl-2,6-diazabicyclo[5.4.0]undeca-2,5,7,9,11-pentaene
| Molecular Formula | C11H12N2 |
|---|---|
| Molecular Weight | 172.10005 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.10005 |
| Monoisotopic Mass | 172.10005 |
| Heavy Atoms | 13 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 58413-99-3 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2N=C(C1)C |
| InChIKey | KSFDHSSNYJNHAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dimethyl-3H-1,5-benzodiazepine (CAS 58413-99-3), with molecular formula C11H12N2 and molecular weight 172.10005 g/mol. IUPAC: 2,4-dimethyl-3H-1,5-benzodiazepine.