Structure Info
- Chemspace ID
- CSCS14929135934 (Synthesis)
- IUPAC Name
- methyl 4-{[3-(diethylamino)propyl]amino}-2-phenyl-8-(propan-2-yl)-5H,8H,9H,10H-pyrimido[4,5-d]azocine-6-carboxylate
- Mol formula
- C27H39N5O2
- Mol weight
- 466 Da
- Catalog Number(s)
- HY-155368
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.85
- Heavy atoms count
- 34
- Rotatable bond count
- 11
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.518
- Polar surface area (Å)
- 71
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS14929135934
Items Overall 2 items from 2 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| MedChemExpress | TBD | United States To: | 90 | 1 mg | POA | |
Description: Names: BChE-IN-20; Product Description: BChE-IN-20 (compound 7c) is a highly potent BChE -selective inhibitor and exhibits IC 50 s of 105 and 2.3 nM for eqBChE and hBChE, respectively. BChE-IN-20 inhibits P glycoprotein with IC 50 of 0.27 μM. BChE-IN-20 is a promising template to improve design and development of BChE-selective ligands of pharmaceutical interest, including inhibitors and fluorogenic probes.; Target: Cholinesterase (ChE); CAS: 1428439-79-5 | ||||||
| MedChemExpress EU | TBD | Sweden To: | 90 | 1 mg | POA | |
Description: Names: BChE-IN-20; Product Description: BChE-IN-20 (compound 7c) is a highly potent BChE-selective inhibitor and exhibits IC50s of 105 and 2.3 nM for eqBChE and hBChE, respectively. BChE-IN-20 inhibits P glycoprotein with IC50 of 0.27 μM. BChE-IN-20 is a promising template to improve design and development of BChE-selective ligands of pharmaceutical interest, including inhibitors and fluorogenic probes.; Target: Cholinesterase (ChE); CAS: 1428439-79-5 | ||||||
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