N-[(4-{[2-(6-aminohexanoyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]carbamoyl}phenyl)methyl]-N-cyclopropyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide; trifluoroacetic acid
Structure Info
- Chemspace ID
- CSSB20591796608 (In-Stock Building Blocks)
- IUPAC Name
- N-[(4-{[2-(6-aminohexanoyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]carbamoyl}phenyl)methyl]-N-cyclopropyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide; trifluoroacetic acid
- Mol formula
- C37H40F3N5O7
- Mol weight
- 724 Da
- Catalog Number(s)
- AA0H18SW, ACM-MG-2929304061, HY-161796A, LA11436, ST0H1ACG, T87964, TX0H1A1C
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.82
- Heavy atoms count
- 52
- Rotatable bond count
- 12
- Number of rings
- 6
- Carbon bond saturation, Fsp3
- 0.378
- Polar surface area (Å)
- 134
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 3
![Chemical structure of N-[(4-{[2-(6-aminohexanoyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]carbamoyl}phenyl)methyl]-N-cyclopropyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide; trifluoroacetic acid (C37H40F3N5O7) - CSSB20591796608](/st/structure/200/c81f8f14a0f21e56fceb5dc15739a9a0/OC%2528%253DO%2529C%2528F%2529%2528F%2529F.NCCCCCC%2528%253DO%2529N1CCC2%253DCC%2528NC%2528%253DO%2529C3%253DCC%253DC%2528CN%2528C4CC4%2529C%2528%253DO%2529C4%253DCC%253DC5NC%2528%253DO%2529COC5%253DC4%2529C%253DC3%2529%253DCC%253DC2C1.png "C37H40F3N5O7")
- Zoom the structure
- CSSB20591796608
Items Overall 6 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 7 days | United States To: | 98 | 1 mg | 338.80 | |
| 1st Scientific LLC | 7 days | United States To: | 98 | 5 mg | 787.60 | |
Description: UNC8732 (TFA); CAS: 2929304-06-1 | ||||||
| A2B Chem | 12 days | United States To: | 98 | 1 mg | 393.30 | |
| A2B Chem | 12 days | United States To: | 98 | 5 mg | 914.25 | |
Description: UNC8732 (TFA); CAS: 2929304-06-1 | ||||||
| 10X CHEM | TBD | United States To: | 98 | 1 mg | 347.60 | |
| 10X CHEM | TBD | United States To: | 98 | 5 mg | 810.70 | |
Description: UNC8732 (TFA); CAS: 2929304-06-1 | ||||||
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