C18H15N3O5
TL;DR: C18H15N3O5 (CAS 1212493-83-8) is a chemical compound with molecular formula C18H15N3O5 and molecular weight 353.10117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[(1S,2R,6S,7R)-3,5-dioxo-4,8,9-triazatricyclo[6.4.0.02,6]dodeca-9,11-diene-7-carbonyl]phenyl] acetate
Also Known As: 4-((4aS,4bR,7aS,8R)-5,7-dioxo-4b,5,6,7,7a,8-hexahydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-8-carbonyl)phenyl acetate, 4-{[(4aS,4bR,7aS,8R)-5,7-dioxo-4b,5,6,7,7a,8-hexahydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazin-8-yl]carbonyl}phenyl acetate
Technical Specifications
| Molecular Formula | C18H15N3O5 |
| Molecular Weight | 353.10117 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.10117 Da |
| Heavy Atoms | 26 |
| Complexity | 722.0 |
| SMILES | CC(=O)OC1=CC=C(C=C1)C(=O)[C@H]2[C@@H]3[C@H]([C@H]4N2N=CC=C4)C(=O)NC3=O |
| InChIKey | MNYXCNOYTXONHX-ZQDZILKHSA-N |
Chemical Property Profile of C18H15N3O5
Property Insights of C18H15N3O5
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C18H15N3O5. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C18H15N3O5. Following Lipinski's Rule of Five, C18H15N3O5 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C18H15N3O5?
The CAS number of C18H15N3O5 is 1212493-83-8.
What is the molecular formula of C18H15N3O5?
The molecular formula of C18H15N3O5 is C18H15N3O5.
What is the molecular weight of C18H15N3O5?
The molecular weight of C18H15N3O5 is 353.10117 g/mol.
Where can I buy C18H15N3O5?
You can request a quote for C18H15N3O5 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C18H15N3O5?
Yes, CoreyChem provides custom synthesis services for C18H15N3O5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.