J3.805.251I
TL;DR: J3.805.251I (CAS 38848-24-7) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(13,15-dioxa-7-azatetracyclo[8.7.0.03,7.012,16]heptadeca-1(17),2,10,12(16)-tetraen-2-yl)propane-1,2-dione
Also Known As: J3.805.251I, 1-(5,8,9,10-Tetrahydro-2H,6H-[1,3]dioxolo[4,5-h]pyrrolo[2,1-b][3]benzazepin-11-yl)propane-1,2-dione, 1-(5,8,9,10-tetrahydro-6H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d, 1-{13,15-dioxa-7-azatetracyclo[8.7.0.03,7.012,16]heptadeca-1(17),2,10,12(16)-tetraen-2-yl}propane-1,2-dione
| Molecular Formula | C17H17NO4 |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.11575 |
| Heavy Atoms | 22 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 38848-24-7 |
|---|---|
| SMILES | CC(=O)C(=O)C1=C2CCCN2CCC3=CC4=C(C=C31)OCO4 |
| InChIKey | PSHQTGJITCBZDM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
J3.805.251I (CAS 38848-24-7), with molecular formula C17H17NO4 and molecular weight 299.12 g/mol. IUPAC: 1-(13,15-dioxa-7-azatetracyclo[8.7.0.03,7.012,16]heptadeca-1(17),2,10,12(16)-tetraen-2-yl)propane-1,2-dione.
Chemical Property Profile of J3.805.251I
Property Insights of J3.805.251I
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J3.805.251I. With a topological polar surface area (TPSA) of 55.8 Ų, J3.805.251I exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J3.805.251I has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J3.805.251I?
The CAS number of J3.805.251I is 38848-24-7.
What is the molecular formula of J3.805.251I?
The molecular formula of J3.805.251I is C17H17NO4.
What is the molecular weight of J3.805.251I?
The molecular weight of J3.805.251I is 299.12 g/mol.
Where can I buy J3.805.251I?
You can request a quote for J3.805.251I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.805.251I?
Yes, KEHONG BIO provides custom synthesis services for J3.805.251I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.