(4S)-4-benzyl-5-methyl-2,5-diazabicyclo[5.4.0]undeca-7,9,11-triene-3,6-dione (CAS 50886-63-0) — formula C17H16N2O2, molecular weight 280.32; category organic chemicals.
| CAS Number | 50886-63-0 |
|---|---|
| Molecular Formula | C17H16N2O2 |
| Molecular Weight | 280.32 |
| LogP | 2.4 |
| Category | Organic Chemicals |
(4S)-4-benzyl-5-methyl-2,5-diazabicyclo[5.4.0]undeca-7,9,11-triene-3,6-dione is a carbon-based organic compound with CAS registry number 50886-63-0 and molecular formula C17H16N2O2 (molecular weight 280.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 50886-63-0
Its molecular formula C17H16N2O2 comprises 17 C, 16 H, 2 N, 2 O atoms.
Also known as: (4S)-4-benzyl-5-methyl-2,5-diazabicyclo[5.4.0]undeca-7,9,11-triene-3,6-dione · (4S)-4-苄基-5-甲基-2,5-二氮杂双环[5.4.0]十一碳-7,9,11-三烯-3,6-二酮
Category: organic chemicals
The CAS registry number of (4S)-4-benzyl-5-methyl-2,5-diazabicyclo[5.4.0]undeca-7,9,11-triene-3,6-dione is 50886-63-0.
Molecular formula C17H16N2O2, molecular weight 280.32.
It is also registered under: (4S)-4-benzyl-5-methyl-2,5-diazabicyclo[5.4.0]undeca-7,9,11-triene-3,6-dione, (4S)-4-苄基-5-甲基-2,5-二氮杂双环[5.4.0]十一碳-7,9,11-三烯-3,6-二酮.
Category: Organic Chemicals.
Independent reference data for (4S)-4-benzyl-5-methyl-2,5-diazabicyclo[5.4.0]undeca-7,9,11-triene-3,6-dione (CAS 50886-63-0), compiled from public chemistry databases.
| CAS 号 | 50886-63-0 |
|---|---|
| PubChem CID | 179574 |
| 分子式 | C17H16N2O2 |
| IUPAC 名称 | (3S)-3-benzyl-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione |
| UNII（FDA） | MF63NR5JR3 |
| Molecular Weight | 280.32 |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 280.121177757 |
| Monoisotopic Mass | 280.121177757 |
| Topological Polar Surface Area | 49.4 |
| Heavy Atom Count | 21 |
cyclopeptine; 50886-63-0; MF63NR5JR3; 1H-1,4-Benzodiazepine-2,5-dione, 3,4-dihydro-4-methyl-3-(phenylmethyl)-, (3S)-; CHEBI:71320; RefChem:1082740; (S)-cyclopeptine; Cyclopeptin; (3S)-3-benzyl-4-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione; (3S)-3-benzyl-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione; (3S)-3-benzyl-4-methyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2,5-dione; (4S)-4-BENZYL-5-METHYL-2,5-DIAZABICYCLO(5.4.0)UNDECA-7,9,11-TRIENE-3,6-DIONE; (4S)-4-BENZYL-5-METHYL-2,5-DIAZABICYCLO[5.4.0]UNDECA-7,9,11-TRIENE-3,6-DIONE; (-)-cyclopeptine; UNII-MF63NR5JR3; orb2279456
(4S)-4-苄基-5-甲基-2,5-二氮杂双环[5.4.0]十一碳-7,9,11-三烯-3,6-二酮 · CAS 50886-63-0 · C17H16N2O2. UNII MF63NR5JR3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.