C258-0471
TL;DR: C258-0471 (CAS 866016-13-9) is a chemical compound with molecular formula C27H24N4O3S and molecular weight 484.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-(4-ethylphenyl)-9-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-diene-10,12-dione
Also Known As: C258-0471, F1602-0008, 11-(4-ethylphenyl)-9-({6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6)-diene-10,12-dione, 3-(4-ethylphenyl)-1-((6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl)-6,7-dihydro-1H-cyclopenta[4,5]thieno[2,3-d]pyrimidine-2,4(3H,5H)-dione, 11-(4-ethylphenyl)-9-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-diene-10,12-dione
| Molecular Formula | C27H24N4O3S |
|---|---|
| Molecular Weight | 484.16 g/mol |
| LogP | 3.62962 |
| Topological Polar Surface Area | 78.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 484.15692 |
| Heavy Atoms | 35 |
| Complexity | 1806.125 |
Chemical Identifiers
| CAS Number | 866016-13-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2C(=O)C3=C(N(C2=O)CC4=CC(=O)N5C(=CC=CC5=N4)C)SC6=C3CCC6 |
Product Overview
C258-0471 (CAS 866016-13-9), with molecular formula C27H24N4O3S and molecular weight 484.16 g/mol. IUPAC: 11-(4-ethylphenyl)-9-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6)-diene-10,12-dione.
Chemical Property Profile of C258-0471
Property Insights of C258-0471
The XLogP value of 3.62962 indicates that C258-0471 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.37 Ų falls within the moderate polarity range, balancing permeability and solubility for C258-0471. Following Lipinski's Rule of Five, C258-0471 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 C258-0471?
The CAS number of C258-0471 is 866016-13-9.
What is the molecular formula of C258-0471?
The molecular formula of C258-0471 is C27H24N4O3S.
What is the molecular weight of C258-0471?
The molecular weight of C258-0471 is 484.16 g/mol.
Where can I buy C258-0471?
You can request a quote for C258-0471 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C258-0471?
Yes, KEHONG BIO provides custom synthesis services for C258-0471 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.