Cycloanthranilylproline
6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
Also Known As: PBD-5,11-dione|ACMC-20aogp|Cycloanthranilylproline|2,3-Dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11ah)-dione|BAS 09858501|2,3-Dihydro-1H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H,11aH)-dione|6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione|3,9-diazatricyclo[8.4.0.0,3,7]tetradeca-1(14),10,12-triene-2,8-dione|2-Nonenoic acid,3-(trifluoromethyl)-,ethyl ester|AE-473/30080001|SR-01000364944-1|I01-13619|1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione, 2,3-dihydro-
| Molecular Formula | C12H12N2O2 |
|---|---|
| Molecular Weight | 216.08987 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.08987 |
| Monoisotopic Mass | 216.08987 |
| Heavy Atoms | 16 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 24919-40-2 |
|---|---|
| SMILES | C1CC2C(=O)NC3=CC=CC=C3C(=O)N2C1 |
| InChIKey | MXBNEEHQIDLPLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cycloanthranilylproline (CAS 24919-40-2), with molecular formula C12H12N2O2 and molecular weight 216.08987 g/mol. IUPAC: 6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione.