RefChem:1071892
TL;DR: RefChem:1071892 (CAS 100447-53-8) is a chemical compound with molecular formula C17H20N2O and molecular weight 268.15756 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3Z)-N-methyl-3-(5-methyl-6-oxa-4-azatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-2-ylidene)propan-1-amine
Also Known As: 4H-Benzo(5,6)cyclohept(1,2-d)oxazole, 9,10-dihydro-2-methyl-4-(3-(methylamino)propylidene)-, 9,10-Dihydro-2-methyl-4-(3-(methylamino)propylidene)-4H-benzo(5,6)cyclohept(1,2-d)oxazole, 4H-BENZO(5,6)CYCLOHEPT(1,2-d)OXAZOLE, 9,10-DIHYDRO-2-METHYL-4-(3-(METHYLAMINO)PR
Technical Specifications
| Molecular Formula | C17H20N2O |
| Molecular Weight | 268.15756 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.15756 Da |
| Heavy Atoms | 20 |
| Complexity | 355.0 |
| SMILES | CC1=NC\2=C(O1)CCC3=CC=CC=C3/C2=C/CCNC |
| InChIKey | KDHDEIJYDXCXNG-NVNXTCNLSA-N |
Chemical Property Profile of RefChem:1071892
Property Insights of RefChem:1071892
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1071892. With a topological polar surface area (TPSA) of 38.1 Ų, RefChem:1071892 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1071892 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1071892?
The CAS number of RefChem:1071892 is 100447-53-8.
What is the molecular formula of RefChem:1071892?
The molecular formula of RefChem:1071892 is C17H20N2O.
What is the molecular weight of RefChem:1071892?
The molecular weight of RefChem:1071892 is 268.15756 g/mol.
Where can I buy RefChem:1071892?
You can request a quote for RefChem:1071892 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1071892?
Yes, CoreyChem provides custom synthesis services for RefChem:1071892 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.