C14H13NO5
TL;DR: C14H13NO5 (CAS 1212428-47-1) is a chemical compound with molecular formula C14H13NO5 and molecular weight 275.07938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-methoxyphenyl)-3,9,11-trioxa-4-azatricyclo[6.2.1.02,6]undec-4-en-7-one
Also Known As: ZERO/004970, 3-(4-methoxyphenyl)-3a,7,8,8a-tetrahydro-5,8-epoxyoxepino[4,5-d][1,2]oxazol-4(5H)-one, 5-(4-methoxyphenyl)-3,9,11-trioxa-4-azatricyclo[6.2.1.02,6]undec-4-en-7-one, (2S,8R)-5-(4-Methoxy-phenyl)-3,9,11-trioxa-4-aza-tricyclo[6.2.1.0*2,6*]undec-4-en-7-one, 3-(4-METHOXYPHENYL)-3A,7,8,8A-TETRAHYDRO-5,8-EPOXYOXEPINO[4,5-D]ISOXAZOL-4(5H)-ONE
Technical Specifications
| Molecular Formula | C14H13NO5 |
| Molecular Weight | 275.07938 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.07938 Da |
| Heavy Atoms | 20 |
| Complexity | 443.0 |
| SMILES | COC1=CC=C(C=C1)C2=NOC3C2C(=O)C4OCC3O4 |
| InChIKey | LEMKRLXDXXQHNC-UHFFFAOYSA-N |
Chemical Property Profile of C14H13NO5
Property Insights of C14H13NO5
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C14H13NO5. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for C14H13NO5. Following Lipinski's Rule of Five, C14H13NO5 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C14H13NO5?
The CAS number of C14H13NO5 is 1212428-47-1.
What is the molecular formula of C14H13NO5?
The molecular formula of C14H13NO5 is C14H13NO5.
What is the molecular weight of C14H13NO5?
The molecular weight of C14H13NO5 is 275.07938 g/mol.
Where can I buy C14H13NO5?
You can request a quote for C14H13NO5 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C14H13NO5?
Yes, CoreyChem provides custom synthesis services for C14H13NO5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.