7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione
TL;DR: 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione (CAS 7675-35-6) is a chemical compound with molecular formula C21H17NO4 and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-oxobutanoyl)-9,9a-dihydropyrido[1,2-f]phenanthridine-6,8-dione
Also Known As: J1.392.874F, 3-Acetoacetyl-1,13b-dihydro-4a-azatriphenylene-2,4(3H)-dione, 7-Acetoacetyl-9,9a-dihydro-6H-pyrido[1,2-f]phenanthridine-6,8(7H)-dione, 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido[1,2-f]phenanthridine-6,8(7H)-dione, 7-(3-oxobutanoyl)-7,8,9,9a-tetrahydro-6H-5a-azatriphenylene-6,8-dione
| Molecular Formula | C21H17NO4 |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.11575 |
| Heavy Atoms | 26 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 7675-35-6 |
|---|---|
| SMILES | CC(=O)CC(=O)C1C(=O)CC2C3=CC=CC=C3C4=CC=CC=C4N2C1=O |
| InChIKey | SYRWPNWIWTUDTR-UHFFFAOYSA-N |
Product Overview
7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione (CAS 7675-35-6), with molecular formula C21H17NO4 and molecular weight 347.12 g/mol. IUPAC: 7-(3-oxobutanoyl)-9,9a-dihydropyrido[1,2-f]phenanthridine-6,8-dione.
Chemical Property Profile of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione
Property Insights of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione. Following Lipinski's Rule of Five, 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione has 0 hydrogen bond donor(s) and 4 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 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione?
The CAS number of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione is 7675-35-6.
What is the molecular formula of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione?
The molecular formula of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione is C21H17NO4.
What is the molecular weight of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione?
The molecular weight of 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione is 347.12 g/mol.
Where can I buy 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione?
You can request a quote for 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-(1,3-Dioxobutyl)-9,9a-dihydro-6H-pyrido(1,2-f)phenanthridine-6,8(7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.