C258-0573
TL;DR: C258-0573 (CAS 865655-47-6) is a chemical compound with molecular formula C25H21Cl2N3O3S and molecular weight 513.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide
Also Known As: C258-0573, F1601-0081, N-(3-chlorophenyl)-2-(3-(4-chlorophenyl)-2,4-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1-yl)acetamide, N-(3-chlorophenyl)-2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7)-dien-6-yl]acetamide, N-(3-chlorophenyl)-2-[3-(4-chlorophenyl)-2,4-dioxo-3,4,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-1(5H)-yl]acetamide
| Molecular Formula | C25H21Cl2N3O3S |
|---|---|
| Molecular Weight | 513.07 g/mol |
| LogP | 5.4283 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 513.06805 |
| Heavy Atoms | 34 |
| Complexity | 1519.6787 |
Chemical Identifiers
| CAS Number | 865655-47-6 |
|---|---|
| SMILES | C1CCC2=C(CC1)SC3=C2C(=O)N(C(=O)N3CC(=O)NC4=CC(=CC=C4)Cl)C5=CC=C(C=C5)Cl |
Product Overview
C258-0573 (CAS 865655-47-6), with molecular formula C25H21Cl2N3O3S and molecular weight 513.07 g/mol. IUPAC: N-(3-chlorophenyl)-2-[4-(4-chlorophenyl)-3,5-dioxo-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7)-dien-6-yl]acetamide.
Chemical Property Profile of C258-0573
Property Insights of C258-0573
The XLogP value of 5.4283 indicates that C258-0573 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C258-0573. Following Lipinski's Rule of Five, C258-0573 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C258-0573?
The CAS number of C258-0573 is 865655-47-6.
What is the molecular formula of C258-0573?
The molecular formula of C258-0573 is C25H21Cl2N3O3S.
What is the molecular weight of C258-0573?
The molecular weight of C258-0573 is 513.07 g/mol.
Where can I buy C258-0573?
You can request a quote for C258-0573 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C258-0573?
Yes, KEHONG BIO provides custom synthesis services for C258-0573 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.