BAS 13726946
TL;DR: BAS 13726946 (CAS 1005288-37-8) is a chemical compound with molecular formula C17H19NO3 and molecular weight 285.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3,4-dimethylphenyl)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxamide
Also Known As: BAS 13726946, N-(3,4-dimethylphenyl)-2-oxohexahydro-2H-3,5-methanocyclopenta[b]furan-7-carboxamide, N-(3,4-dimethylphenyl)-5-oxo-4-oxatricyclo[4.2.1.0~3,7~]nonane-9-carboxamide, N-(3,4-dimethylphenyl)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carboxamide
Technical Specifications
| Molecular Formula | C17H19NO3 |
| Molecular Weight | 285.1365 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.1365 Da |
| Heavy Atoms | 21 |
| Complexity | 477.0 |
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2C3CC4C2C(=O)OC4C3)C |
| InChIKey | KOYCMMLKCIBGMF-UHFFFAOYSA-N |
Chemical Property Profile of BAS 13726946
Property Insights of BAS 13726946
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 13726946. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 13726946 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 13726946 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 BAS 13726946?
The CAS number of BAS 13726946 is 1005288-37-8.
What is the molecular formula of BAS 13726946?
The molecular formula of BAS 13726946 is C17H19NO3.
What is the molecular weight of BAS 13726946?
The molecular weight of BAS 13726946 is 285.1365 g/mol.
Where can I buy BAS 13726946?
You can request a quote for BAS 13726946 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 13726946?
Yes, CoreyChem provides custom synthesis services for BAS 13726946 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.